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HBCChem, Inc.

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Web: http://www.hbcchem-inc.com
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Address: 2819 Whipple Road, Union City, California 94587, USA
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Profile: HBCChem, Inc. specializes in fine chemicals and custom synthesis. Our fine chemicals include esmolo hydrochloride, 1-ethyl-2,3-dioxopiperazine, oxprenolol succinate, tienoxolol hydrochloride and orlistat. Our main chemical products include unnatural amino acids, hydrazine, piperazine, 5-member & 6-member heterocylic compounds, and organometallic catalysts. Pyrrolidine is found naturally in the leaves of tobacco and carrot. The pyrrolidine ring structure is present in numerous natural alkaloids such as nicotine and hygrine. It is found in many pharmaceutical drugs such as procyclidine and bepridil.

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• Desoxyanisoin
IUPAC Name: 1,2-bis(4-methoxyphenyl)ethanone | CAS Registry Number: 120-44-5
Synonyms: Deoxyanisoin, Deoxy-4-anisoin, Deoxy-p-anisoin, 4,4'-Dimethoxydeoxybenzoin, D5608_ALDRICH, Oprea1_141732, NSC8793, CHEBI:112197, 1,2-Bis(4-methoxyphenyl)ethanone, AIDS010134, BB_NC-0199, AIDS-010134, CID67120, Ethanone, 1,2-bis(4-methoxyphenyl)-, NSC26660, EINECS 204-396-8, ZINC00057138, 1,2-Bis-(4-methoxy-phenyl)-ethanone, 4-Methoxybenzyl 4-methoxyphenyl ketone, AI3-25259

Molecular Formula: C16H16O3Molecular Weight: 256.296440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SICBLYCPRWNHHP-UHFFFAOYSA-N

• DHBP
IUPAC Name: (2,4-dihydroxyphenyl)-phenylmethanone | CAS Registry Number: 131-56-6
Synonyms: Benzoresorcinol, Resbenzophenone, Benzophenone-1, Inhibitor DHBP, Advastab 48, Uvistat 12, 4-Benzoyl resorcinol, Uvinol 400, Uvinul 400, Quinsorb 010, Syntase 100, Eastman Inhibitor DHPB, Dastib 263, DHBP cpd, 4-Benzoylresorcinol, Benzophenone, 2,4-dihydroxy-, 2,4-DIHYDROXYBENZOPHENONE, Enamine_001926, UF 1, USAF DO-28

Molecular Formula: C13H10O3Molecular Weight: 214.216700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZXDDPOHVAMWLBH-UHFFFAOYSA-N

• Diaminomaleonitrile
IUPAC Name: (Z)-2,3-diaminobut-2-enedinitrile | CAS Registry Number: 1187-42-4
Synonyms: DIAMINOMALEONITRILE, 2,3-Diaminomaleonitrile, Hydrogen cyanide tetramer, Maleonitrile, diamino-, DAMN, 2,3-Dicyanoethenediamine, Butenedinitrile, diamino-, CCRIS 921, 163880_ALDRICH, 2,3-Diamino-2-butenedinitrile, 2,3-Diaminobut-2-enedinitrile, Maleonitrile, diamino- (8CI), EINECS 214-697-6, 1,2-Diamino-1,2-dicyanoethylene, 2-Butenedinitrile, 2,3-diamino-, (2Z)-2,3-Diamino-2-butenedinitrile, NSC 266758, 2-Butenedinitrile, 2,3-diamino-, (Z)-, LS-611, NSC266758

Molecular Formula: C4H4N4Molecular Weight: 108.101360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DPZSNGJNFHWQDC-ARJAWSKDSA-N

• Diethylaminoethoxyethanol
IUPAC Name: 2-(2-diethylaminoethyloxy)ethanol | CAS Registry Number: 140-82-9
Synonyms: Diethylamine, ethoxylated, Emery 6771, N,N-Diethylethoxyethanolamine, 2-(2-Diethylaminoethoxy)-ethanol, 2-(2-(Diethylamino)ethoxy)ethanol, EINECS 205-436-7, 2-(beta-(Diethylamino)ethoxy)ethanol, 2-.beta.-Diethylaminoethoxyethanol, NSC 163322, Polyoxyethylene-N,N-diethylethanolamine, 2-[2-(Diethylamino)ethoxy]ethanol, XC-2299, Ethanol, 2-(2-(diethylamino)ethoxy)-, NSC163322, Ethanol, 2-[2-(diethylamino)ethoxy]-, LS-66668, LS-118165, alpha-(2-(Diethylamino)ethyl)-omega-hydroxypoly(oxy-1,2-ethanediyl), Poly(oxy-1,2-ethanediyl), alpha-(2-(diethylamino)ethyl)-omega-hydroxy-, 63833-83-0

Molecular Formula: C8H19NO2Molecular Weight: 161.241960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: VKBVRNHODPFVHK-UHFFFAOYSA-N

• Diethylthioxanthone
IUPAC Name: 2,4-diethylthioxanthen-9-one | CAS Registry Number: 82799-44-8
Synonyms: 406368_ALDRICH, 2,4-Diethyl-thioxanthen-9-one, 2,4-Diethyl-9H-thioxanthen-9-one, EINECS 280-041-0, ZINC04718909, 9H-Thioxanthen-9-one, 2,4-diethyl-, BAS 00532177, ST5233567, 153859-04-2, 162774-73-4

Molecular Formula: C17H16OSMolecular Weight: 268.373340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BTJPUDCSZVCXFQ-UHFFFAOYSA-N

• Dihydroxydibenzanthrone
Synonyms: Dihydroxyviolanthron, Violanthrone, dihydroxy-, 16,17-Dihydroxyviolanthrone, 16,17-Dihydroxydibenzanthrone, Dihydroxyviolanthron [Czech], Violanthrone, 16,17-dihydroxy-, EINECS 204-897-1, CHEBI:325621, NSC 23126, NSC23126, BRN 2030453, ZINC04429711, 16,17-Dihydroxyviolanthrene-5,10-dione, CID5354980, LS-62045, Violanthrone, 16,17-dihydroxy- (8CI), 4-08-00-03338 (Beilstein Handbook Reference), Dihydro-dinaphthol(1,2,3-cd:3',2',1'-im)perylene-5,10-dione, Dinaphtho(1,2,3-cd:3',2',1'-lm)perylene-5,10-dione, 16,17-dihydroxy-, Anthra(9,1,2-cde)benzo(rst)pentaphene-5,10-dione, 16,17-dihydroxy-

Molecular Formula: C34H16O4Molecular Weight: 488.488440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MGYICCKROPVHMA-UHFFFAOYSA-N

• Dimercaprol
IUPAC Name: 2,3-bis(sulfanyl)propan-1-ol | CAS Registry Number: 59-52-9
Synonyms: Dithioglycerine, DIMERCAPROL, Sulfactin, Dicaptol, Dimersol, Antoxol, Panobal, dimercaptopropanol, Dithioglycerol, Dimercaptol, British antilewisite, Dimercaprol propanol, 2,3-Dimercapto-1-propanol, BAL in Oil, Usaf me-1, 1,2-Dithioglycerol, 2,3-Dithiopropanol, Sulfactin (VAN), British Anti-Lewisite, Dimerkaprol [Czech]

Molecular Formula: C3H8OS2Molecular Weight: 124.225020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WQABCVAJNWAXTE-UHFFFAOYSA-N

• Dimercapto Thiadiazole
IUPAC Name: 1,3,4-thiadiazolidine-2,5-dithione | CAS Registry Number: 1072-71-5
Synonyms: Bismuthiol I, Dimercaptothiadiazole, Bismuththiol i, Usaf fa-4, 2,5-Dimercaptothiadiazole, BISMUTH THIOL I, Usafa-8354, USAF A-8354, 1,3,4-Thiadiazolidine-2,5-dithione, 2,5-Dimercapto-thiadiazole, 2,5-Dimercapto-1,3,4-thiadiazole, PY 61H, 1,3,4-THIADIAZOLE-2,5-DITHIOL, D129003_ALDRICH, WLN: T5NNDSJ CSH ESH, 2,5-Dimercapto-1,3,4-thiodiazole, NSC4645, WLN: T5NN DSJ CSH ESH, NSC 4645, 15100_FLUKA

Molecular Formula: C2H2N2S3Molecular Weight: 150.245680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: BIGYLAKFCGVRAN-UHFFFAOYSA-N

• Dimercaptopropane Sulfonic Acid, Sodium Salt
IUPAC Name: 2,3-bis(sulfanyl)propane-1-sulfonic acid | CAS Registry Number: 4076-02-2
Synonyms: parent cpd, DMPS, CHEBI:888, 2,3-Dimercaptopropanesulfonic acid, C3H8O3S3, AIDS004445, 2,3-DIMERCAPTO-1-PROPANESULFONIC ACID, 2,3-Dimercaptopropane-1-sulfonic acid, AIDS-004445, DL-2,3-Dimercaptopropane-1-sulfonic acid, BRN 1763751, 2,3-Dimercaptopropan-1-sulfonsaeure, 1-Propanesulfonic acid, 2,3-dimercapto-, (+-)-2,3-Dimercapto-1-propanesulfonic acid, 2,3-disulfanylpropane-1-sulfonic acid, 4076-02-2 (SODIUM SALT), 2,3-Dimercaptopropan-1-sulfonsaeure [German], LS-120955, C10922, 4-04-00-00094 (Beilstein Handbook Reference)

Molecular Formula: C3H8O3S3Molecular Weight: 188.288820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JLVSRWOIZZXQAD-UHFFFAOYSA-N

• Dimethyl Hexynediol
IUPAC Name: 2,5-dimethylhex-3-yne-2,5-diol | CAS Registry Number: 142-30-3
Synonyms: Dimethylhexynediol, Acetylenepinacol, Kemitracin-50, Olfine Y, Tetramethylbutynediol, Tetramethyl-2-butynediol, 3-Hexyne-2,5-diol, 2,5-dimethyl-, 2,5-Dimethylhexyne-2,5-diol, HSDB 5639, D 43, 2,5-DIMETHYL-3-HEXYNE-2,5-DIOL, 222623_ALDRICH, D 43 (VAN), EINECS 205-533-4, ZERO/001274, NSC8340, AIDS017555, NSC 117261, 2,5-dimethylhex-3-yne-2,5-diol, AIDS-017555

Molecular Formula: C8H14O2Molecular Weight: 142.195560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IHJUECRFYCQBMW-UHFFFAOYSA-N

• Dimethyl-L-Tartrate
IUPAC Name: dimethyl (2R,3R)-2,3-dihydroxybutanedioate | CAS Registry Number: 608-68-4
Synonyms: ()-Dimethyl L-tartrate, L-DIMETHYL TARTRATE, 163457_ALDRICH, 95365_FLUKA, Dimethyl (R(R*,R*))-tartrate, BB_NC-0150, L-()-Tartaric acid dimethyl ester, EINECS 210-166-8, ZINC01555576, Butanedioic acid, 2,3-dihydroxy- (2R,3R)-, dimethyl ester, 117356-23-7, 72718-98-0, 89599-43-9

Molecular Formula: C6H10O6Molecular Weight: 178.140000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: PVRATXCXJDHJJN-QWWZWVQMSA-N

• Dimethylacetonedicarboxylate
IUPAC Name: dimethyl 3-oxopentanedioate | CAS Registry Number: 1830-54-2
Synonyms: Dimethyl 3-oxoglutarate, Dimethyl 3-oxopentanedioate, Dimethyl-3-oxoglutarate, Dimethyl acetonedicarboxylate, Dimethyl beta-oxoglutarate, Dimethyl .beta.-oxoglutarate, D138002_ALDRICH, Dimethyl 1,3-acetonedicarboxylate, Pentanedioic acid, 3-oxo-, dimethyl ester, Acetone dicarboxylic acid, dimethyl ester, NSC4677, Dimethyl-1,3-acetonedicarboxylate, Glutaric acid, 3-oxo-, dimethyl ester, NSC 4677, EINECS 217-385-8, ZINC01680028, AI3-05633, ST5308242, ACETONEDICARBOXYLIC ACID, DIMETHYLESTER, 3-OXO-PENTANEDIOIC ACIDO,DIMETHYL ESTER

Molecular Formula: C7H10O5Molecular Weight: 174.151300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: RNJOKCPFLQMDEC-UHFFFAOYSA-N

• Dimethyltrimethylene Glycol
IUPAC Name: 2,2-dimethylpropane-1,3-diol | CAS Registry Number: 126-30-7
Synonyms: Dimethylolpropane, Neopentanediol, Neopentyl glycol, Neol, Neopentylene glycol, Neopentylglycol, Hydroxypivalyl alcohol, NPG Glycol, Dimethyltrimethylene glycol, 1,3-Propanediol, 2,2-dimethyl-, 2,2-Dimethyl-1,3 propanediol, 2,2-Dimethylpropane-1,3-diol, CCRIS 3273, 2,2-Dimethyltrimethylene glycol, CBDivE_004836, 2,2-DIMETHYL-1,3-PROPANEDIOL, 538256_ALDRICH, 2,3-Dimethyl-1,3-propanediol, 41510_FLUKA, EINECS 204-781-0

Molecular Formula: C5H12O2Molecular Weight: 104.147580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SLCVBVWXLSEKPL-UHFFFAOYSA-N

• Dioxybenzone
IUPAC Name: (2-hydroxy-4-methoxyphenyl)-(2-hydroxyphenyl)methanone | CAS Registry Number: 131-53-3
Synonyms: dioxybenzone, Dioxybenzon, Dioxibenzonum, Solaquin, Advastab 47, Benzophenone-8, Cyasorb UV 24, Spectra-sorb UV 24, Mixture Name, Cyasorb UV 24 Light Absorber, Spectrum_000978, UF 2, Dioxybenzone [USAN:INN], Dioxybenzonum [INN-Latin], Dioxibenzona [INN-Spanish], Prestwick0_000898, Prestwick1_000898, Prestwick2_000898, Prestwick3_000898, Spectrum2_001032

Molecular Formula: C14H12O4Molecular Weight: 244.242680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MEZZCSHVIGVWFI-UHFFFAOYSA-N

• DL-α-Amino-2-Thiopheneacetic Acid
IUPAC Name: (2S)-2-azaniumyl-2-thiophen-2-ylacetate | CAS Registry Number: 21124-40-3
Synonyms: ZINC00155405, CID6931287

Molecular Formula: C6H7NO2SMolecular Weight: 157.190280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XLMSKXASROPJNG-RXMQYKEDSA-N

• DL-a-(3-Thienyl)glycine
IUPAC Name: 2-amino-2-thiophen-3-ylacetic acid | CAS Registry Number: 38150-49-1
Synonyms: Amino-thiophen-3-yl-acetic acid, DL-alpha-(3-Thienyl)glycine, 2-(3-Thienyl)glycine, amino(thien-3-yl)acetic acid, 2-Amino-2-(3-thienyl)acetic acid, 2-Amino-2-(thiophen-3-yl)acetic acid, D-2-(3-Thienyl)-glycine, L-alpha-(3-Thienyl)glycine, Amino-thiophen-3-yl-aceticacid, 1194-86-1, Amino(3-thienyl)acetic acid, ACMC-20eplj, (R)-3-Thienylglycine, dl-a-(3-thienyl)glycine, D-(-)-3-Thienylglycine, Bionet2_000777, dl-2-(3-Thienyl)glycine, SureCN352655, AC1L2T3I, T8528_SIGMA

Molecular Formula: C6H7NO2SMolecular Weight: 157.190280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BVGBBSAQOQTNGF-UHFFFAOYSA-N

• Dodecyl Mercaptan
IUPAC Name: dodecane-1-thiol | CAS Registry Number: 112-55-0
Synonyms: n-Dodecanethiol, 1-DODECANETHIOL, Lauryl mercaptan, Dodecyl mercaptan, Dodecylmercaptan, n-Dodecyl mercaptan, Dodecane-1-thiol, N-Dodecylmercaptan, Pennfloat M, Pennfloat S, 1-Mercaptododecane, n-Lauryl mercaptan, Dodecanethiol, Lauryl mercaptide, Dodecyl thiol, 1-Dodecyl mercaptan, M-Lauryl mercaptan, M-Dodecyl mercaptan, Mercaptan C12, Isododecyl mercaptan

Molecular Formula: C12H26SMolecular Weight: 202.399840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WNAHIZMDSQCWRP-UHFFFAOYSA-N

• Dodecylbenzene
IUPAC Name: dodecylbenzene | CAS Registry Number: 123-01-3
Synonyms: Benzene, dodecyl-, Marlican, Alkane, 1-Phenyldodecane, n-Dodecylbenzene, Laurylbenzene, DODECYLBENZENE, Detergent alkylate, Dodecane, 1-phenyl-, Phenyldodecan, Phenyldodecane, Alkylate P 1, Nalkylene 500, Dodecylbenzene, crude, Ucane alkylate 12, Dodecane, phenyl-, Phenyldodecan [German], Dodecylbenzene (linear), Detergent Alkylate No. 2, n-DODECYL BENZENE

Molecular Formula: C18H30Molecular Weight: 246.430800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KWKXNDCHNDYVRT-UHFFFAOYSA-N

• Ephedrine Hydrochloride
IUPAC Name: (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride | CAS Registry Number: 50-98-6
Synonyms: Ephedronguent, Bronkotabs, Quadrinal, Altusin, Tedral, Bena-fedrin, Primatene Tablets, Ephedrine hydrochloride, Mixture Name, Mudrane GG Elixir, Ephedrinium chloride, L-Ephedrine hydrochloride, 1-Ephedrine hydrochloride, l-Ephedrine, hydrochloride, (-)-Ephedrin hydrochloride, (-)-Ephedrine hydrochloride, Ephedrine L- hydrochloride, C10H15NO.HCl, Ephedrine hydrochloride (TN), 285749_ALDRICH

Molecular Formula: C10H16ClNOMolecular Weight: 201.693140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: BALXUFOVQVENIU-GNAZCLTHSA-N

• Ethoxymethylenemalononitrile
IUPAC Name: 2-(ethoxymethylidene)propanedinitrile | CAS Registry Number: 123-06-8
Synonyms: (Ethoxymethylene)malononitrile, 2-Cyano-3-ethoxyacrylonitrile, Ethoxymethylene malononitrile, USAF KF-10, Propanedinitrile, (ethoxymethylene)-, (Ethoxymethylene)propanedinitrile, USAF A-9230, E6200_ALDRICH, Malononitrile, (ethoxymethylene)-, WLN: NCYCN & 1O2, 2-(Ethoxymethylene)malononitrile, EINECS 204-597-0, ZERO/001251, NSC 27792, NSC27792, BRN 1634241, ZINC01641627, .alpha.-Cyano-.beta.-ethoxyacrylonitrile, AI3-28939, LS-88928

Molecular Formula: C6H6N2OMolecular Weight: 122.124640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OEICGMPRFOJHKO-UHFFFAOYSA-N

• Ethyl 1-Naphthaleneacetate
IUPAC Name: ethyl 2-naphthalen-1-ylacetate | CAS Registry Number: 2122-70-5
Synonyms: Ethyl 1-naphthylacetate, Ethyl naphthaleneacetate, Ethyl 1-naphthaleneacetate, Caswell No. 589AA, 1-Naphthaleneacetic acid, ethyl ester, EINECS 218-332-1, 1-Naphthylacetic acid ethyl ester, MolPort-000-927-924, NSC 74497, alpha-Naphthaleneacetic acid, ethyl ester, EPA Pesticide Chemical Code 056008, 2-(1-Naphthyl)acetic acid ethyl ester, CID62428, NSC74497, 1-Naphththaleneacetic acid, ethyl ester, BRN 1106730, 1-Naphthaleneacetic Acid Ethyl Ester, ZINC00394916, AI3-02254, BBV-24870081

Molecular Formula: C14H14O2Molecular Weight: 214.259760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XIDPSKQLXKCVQN-UHFFFAOYSA-N

• Ethyl 2-aminothiazole-4-carboxylate
IUPAC Name: ethyl 2-amino-1,3-thiazole-4-carboxylate | CAS Registry Number: 5398-36-7
Synonyms: TimTec1_000957, Oprea1_347195, Oprea1_396207, NSC4464, AIDS073075, AIDS-073075, ALBB-005840, NSC 4464, NSC43547, NSC 43547, SBB000178, ZINC01246200, E2339G1, SDCCGMLS-0065431.P001, SDCCGMLS-0065431.P002, NCGC00174941-01, BAS 00084455, ethyl 2-amino-1,3-thiazole-4-carboxylate, AI3-18592, TL8003539

Molecular Formula: C6H8N2O2SMolecular Weight: 172.204920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: XHFUVBWCMLLKOZ-UHFFFAOYSA-N

• Eucalyptol
IUPAC Name: 4,7,7-trimethyl-8-oxabicyclo[2.2.2]octane | CAS Registry Number: 470-82-6
Synonyms: cineole, 1,8-Cineole, Cajeputol, Zineol, Eucalyptole, Eucapur, 1,8-Cineol, Terpan, p-Cineole, 1,8-Epoxy-p-menthane, Cucalyptol, Soledum, Limonene oxide, 1,8-Oxido-p-menthane, Zedoary oil, Cineole (VAN), Eukalyptol [Czech], Eucalyptol [USAN], Eucalyptol (natural), Eucalyptol (USAN)

Molecular Formula: C10H18OMolecular Weight: 154.249320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WEEGYLXZBRQIMU-UHFFFAOYSA-N

• Fluoronaphthalene
IUPAC Name: 1-fluoronaphthalene | CAS Registry Number: 321-38-0
Synonyms: Naphthalene, 1-fluoro-, 1-FLUORONAPHTHALENE, alpha-Fluoronaphthalene, .alpha.-Fluoronaphthalene, 1-Fluornaftalen [Czech], WLN: L66J BF, 196657_ALDRICH, 442266_SUPELCO, NSC 4690, EINECS 206-287-0, NSC4690, JRD-1263, BRN 1906413, LS-94702, TL8002443, 4-05-00-01657 (Beilstein Handbook Reference), InChI=1/C10H7F/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7

Molecular Formula: C10H7FMolecular Weight: 146.160983 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CWLKTJOTWITYSI-UHFFFAOYSA-N

• Fmoc-1-amino-1-cyclopentanecarboxylic acid
IUPAC Name: 1-(9H-fluoren-9-ylmethoxycarbonylamino)cyclopentane-1-carboxylate | CAS Registry Number: 117322-30-2
Synonyms: ZINC00621979, CID6957978

Molecular Formula: C21H20NO4-Molecular Weight: 350.387800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IECZEINPZOFWNU-UHFFFAOYSA-M

• Fmoc-L-3-(2-Furyl)-alanine
IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-furan-2-ylpropanoic acid | CAS Registry Number: 159611-02-6
Synonyms: Fmoc-L-2-Furylalanine, Fmoc-beta-(2-furyl)-Ala-OH, Fmoc-3-(2-furyl)-L-alanine, 00351_FLUKA, FL370-1, TL8006202, (S)-2-(Fmoc-amino)-3-(2-furyl)propionicacid

Molecular Formula: C22H19NO5Molecular Weight: 377.389960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: AJXDCHXGNUFBRC-FQEVSTJZSA-N

• Glycidyl Nosylate
IUPAC Name: [(2R)-oxiran-2-yl]methyl 3-nitrobenzenesulfonate | CAS Registry Number: 115314-17-5
Synonyms: CCRIS 6393, 50047_FLUKA, (R)-Glycidyl 3-nitrobenzenesulfonate, BRN 4704458, ZINC01728514, (R)-(-)-Glycidyl 3-nitrobenzenesulfonate, Oxiranylmethyl (R)-3-nitrobenzenesulfonate, LS-32036, (R)-(−)-Glycidyl 3-nitrobenzenesulfonate, Benzenesulfonic acid, 3-nitro-, oxiranylmethyl ester, (R)-, (R)-(−)-Oxirane-2-methanol 3-nitrobenzenesulfonate

Molecular Formula: C9H9NO6SMolecular Weight: 259.235860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: AIHIHVZYAAMDPM-MRVPVSSYSA-N

• Glycine, N-((1-methyl-5-(4-methylbenzoyl)-1H-pyrrol-2-yl)acetyl)-
IUPAC Name: 2-[[2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetyl]amino]acetic acid | CAS Registry Number: 87344-05-6
Synonyms: Tolmetin glycinamide, Tolmetin glycineamide, Tolmetin glycine amide, Mcn 4366, Mcn-4366, CID135911

Molecular Formula: C17H18N2O4Molecular Weight: 314.335820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: IYNXNYQOVKPFMM-UHFFFAOYSA-N

• Griseofulvin
IUPAC Name: (2S,5'R)-7-chloro-3',4,6-trimethoxy-5'-methylspiro[1-benzofuran-2,4'-cyclohex-2-ene]-1',3-dione | CAS Registry Number: 126-07-8
Synonyms: griseofulvin, Fulvicin, Amudane, Delmofulvina, Griscofulvin, Griseofulvinum, Grizeofulvin, Fulvistatin, Grisefuline, Grisofulvin, Spirofulvin, Fulvinil, Fungivin, Gresfeed, Grifulin, Grifulvin, Grisactin, Griseomix, Grisetin, Grisovin

Molecular Formula: C17H17ClO6Molecular Weight: 352.766280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: DDUHZTYCFQRHIY-RBHXEPJQSA-N

• Hexafluoroisopropanol
IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-ol | CAS Registry Number: 920-66-1
Synonyms: HFIP, Hexafluoro-2-propanol, Bis(trifluoromethyl)methanol, 2H-Hexafluoroisopropanol, Hexafluoroisopropyl alcohol, WLN: FXFFYQXFFF, CCRIS 6043, NCIOpen2_001854, 1,1,1,3,3,3-Hexafluoro-2-propanol, 105228_ALDRICH, 2-Propanol, 1,1,1,3,3,3-hexafluoro-, 325244_ALDRICH, 1,1,1,3,3,3-Hexafluoroisopropanol, 52517_FLUKA, EINECS 213-059-4, NSC 96336, NSC96336, 1,1,1,3,3,3-Hexafluoroisopropyl alcohol, BRN 1841007, ZINC03860857

Molecular Formula: C3H2F6OMolecular Weight: 168.037799 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: BYEAHWXPCBROCE-UHFFFAOYSA-N

• Hexamethylene Diacrylate
IUPAC Name: 6-prop-2-enoyloxyhexyl prop-2-enoate | CAS Registry Number: 13048-33-4
Synonyms: Kayarad HDDA, Hexamethylene acrylate, Sartomer 238, Viscoat 230, NK Ester A HD, Photomer 4017, Sartomer SR 238, Hexaneglycol diarcylate, Setalux UV 2243, Hexamethylene diacrylate, HDODA, 1,6-Hexamethylene diacrylate, 1,6-HEXANEDIOL DIACRYLATE, Acrylic acid, hexamethylene ester, Hexamethylene glycol diacrylate, CCRIS 4823, hexane-1,6-diyl bisacrylate, HSDB 6109, 1,6-Hexanediol di-2-propenoate, 246816_ALDRICH

Molecular Formula: C12H18O4Molecular Weight: 226.268920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FIHBHSQYSYVZQE-UHFFFAOYSA-N

• Hydroxycamptothecin
Synonyms: CHEBI:107427, PubChem13091, AC1N7NVD, Neuro_000051, AGN-PC-001FGE, SureCN9384413, Bio-0126, H3148_FLUKA, H3148_SIGMA, AKOS015901897, TL8000524, N1591, I14-1454, S06-0011, (+/-)-4-ETHYL-4,9-DIHYDROXY-1H-PYRANO[3',4':6,7]INDOLIZINO[1,2-B]QUINOLINE-3,14(4H,12H)-DIONE

Molecular Formula: C20H16N2O5Molecular Weight: 364.351440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: HAWSQZCWOQZXHI-UHFFFAOYSA-N

• Indoline
IUPAC Name: 2,3-dihydro-1H-indole | CAS Registry Number: 496-15-1
Synonyms: Dihydroindole, 1-Azaindan, 2,3-Dihydro-1H-indole, 2,3-DIHYDROINDOLE, 1H-Indole, 2,3-dihydro-, I5605_ALDRICH, 57240_FLUKA, CHEBI:43295, EINECS 207-816-8, BRN 0111915, SBB004291, ZINC00967454, AI3-39164, LS-82883, LS-82884, TL8003301, 5-20-06-00238 (Beilstein Handbook Reference), AG-690/11351758, IDM, InChI=1/C8H9N/c1-2-4-8-7(3-1)5-6-9-8/h1-4,9H,5-6H

Molecular Formula: C8H9NMolecular Weight: 119.163760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: LPAGFVYQRIESJQ-UHFFFAOYSA-N

• INT
IUPAC Name: 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium chloride | CAS Registry Number: 146-68-9
Synonyms: Iodonitrotetrazolium, Iodonitro tetrazolium, Iodonitrotetrazolium chloride, Iodonitrotetrazolium purple, Iodonitrotetrazolium violet, p-Iodonitrotetrazolium Violet, I10406_ALDRICH, CCRIS 4228, I8377_SIAL, 58030_FLUKA, NSC27620, NSC89168, EINECS 205-676-2, NSC 89168, I-7650, 2-(p-Iodophenyl)-3-(p-nitrophenyl)-5-phenyltetrazolium chloride, 2-(p-Iodophenyl)-3-(p-nitrophenyl)-5-(phenyl)-2H-tetrazolium, 2H-Tetrazolium, 2-(4-iodophenyl)-3-(4-nitrophenyl)-5-phenyl-, chloride, 2-(4-Iodophenyl)-3-(4-nitrophenyl)-5-phenyltetrazolium chloride, 2-(4-Iodophenyl)-3-(4-nitrophenyl)-5-phenyl-2H-tetrazolium chloride

Molecular Formula: C19H13ClIN5O2Molecular Weight: 505.696290 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: JORABGDXCIBAFL-UHFFFAOYSA-M

• Isochroman
IUPAC Name: 3,4-dihydro-1H-isochromene | CAS Registry Number: 493-05-0
Synonyms: Isochromane, 1H-2-Benzopyran, 3,4-dihydro-, 3,4-Dihydro-1H-isochromene, I15807_ALDRICH, 3,4-dihydro-1H-2-benzopyran, CHEBI:33225, NSC63362, EINECS 207-774-0, ZINC01691582, SB 01207, InChI=1/C9H10O/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H

Molecular Formula: C9H10OMolecular Weight: 134.175100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HEBMCVBCEDMUOF-UHFFFAOYSA-N

• Isomannide
IUPAC Name: 2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3,6-diol | CAS Registry Number: 641-74-7
Synonyms: isosorbide, Devicoran, Hydronol, Ismotic, Isobide, Sorbid, Vascardin dinitrate, (+)-D-Isosorbide, 1,4-Dianhydrosorbitol, 1,4:3,6-Dianhydromannitol, Oprea1_439690, 1,4:3,6-Dianhydrosorbitol, Mannitol, 1,4:3,6-dianhydro-, D-Glucitol, 1,4:3,6-dianhydro-, EINECS 248-906-7, 1,4:3,6-Dianhydro-D-glucitol, 1,4:3,6-Dianhydro-D-mannitol, 1,4:3,6-Dianhydro-D-sorbitol, NSC40725, D-Mannitol, 1,4:3,6-dianhydro-

Molecular Formula: C6H10O4Molecular Weight: 146.141200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KLDXJTOLSGUMSJ-UHFFFAOYSA-N

• Isonipecotic acid hydrochloride
IUPAC Name: piperidine-4-carboxylic acid hydrochloride | CAS Registry Number: 5984-56-5
Synonyms: SBB003906, 4-PIPERIDINECARBOXYLIC ACID HYDROCHLORIDE

Molecular Formula: C6H12ClNO2Molecular Weight: 165.617980 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: NVUYWKBRSRPYMH-UHFFFAOYSA-N

• Ketoisophorone
IUPAC Name: 2,6,6-trimethylcyclohex-2-ene-1,4-dione | CAS Registry Number: 1125-21-9
Synonyms: 4-Oxoisophorone, Oxopholone, Oxophorone, keto-Isophorone, 6-Oxoisophorone, 4-Oxo-alpha-isophorone, FEMA No. 3421, 2,6,6-Trimethyl-2-cyclohexene-1,4-dione, W342106_ALDRICH, 329517_ALDRICH, 2,6,6-Trimethylcyclohex-2-ene-1,4-dione, 92410_FLUKA, EINECS 214-406-2, BB_NC-0299, CID62374, STK801843, ZINC03881445, 2-CYCLOHEXENE-1,4-DIONE, 2,6,6-TRIMETHYL-, 3,5,5-Trimethyl-2-cyclohexene-1,4-dione, LS-178762

Molecular Formula: C9H12O2Molecular Weight: 152.190380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AYJXHIDNNLJQDT-UHFFFAOYSA-N

• L(-)-Mandelic Acid
IUPAC Name: (2S)-2-hydroxy-2-phenylacetic acid | CAS Registry Number: 17199-29-0
Synonyms: L-mandelic acid, (S)-Mandelic acid, (S)-Mandelate, D-Mandelic acid, (S)-Mandelsaeure, L-()-Mandelic acid, MANDELIC ACID, S(+)-Mandelic Acid, (S)-()-Mandelic acid, Hydroxy(phenyl)acetic acid, M2004_ALDRICH, (S)-2-Hydroxy-2-phenylacetate, (S)-mandelic acid, MLS000069517, L-(+)-MANDELIC ACID, (S)-2-Hydroxy-2-phenylacetic acid, 63462_FLUKA, CHEBI:32800, (2S)-hydroxy(phenyl)acetic acid, CPD-122

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IWYDHOAUDWTVEP-ZETCQYMHSA-N

• L-Beta-Homophenylglycine hydrochloride
IUPAC Name: (3R)-3-amino-3-phenylpropanoic acid | CAS Registry Number: 83649-48-3
Synonyms: (R)-3-amino-3-phenylpropionic acid, AL380-1, TL8000892

Molecular Formula: C9H11NO2Molecular Weight: 165.189140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: UJOYFRCOTPUKAK-MRVPVSSYSA-N

• Lipoic acid
IUPAC Name: 5-[(3R)-dithiolan-3-yl]pentanoic acid | CAS Registry Number: 1200-22-2
Synonyms: lipoic acid, thioctic acid, lipoate, Heparlipon, Biletan, alpha-Lipoic acid, Thioctacid, Thioctidase, Tioctidasi, Lipothion, Thioctsan, Tioctacid, Liposan, alpha-liponic acid, Thioctanoic acid, (R)-lipoic acid, Protogen A, Thiooctanoic acid, R-Lipoate, R-Lipoic acid

Molecular Formula: C8H14O2S2Molecular Weight: 206.325560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AGBQKNBQESQNJD-SSDOTTSWSA-N

• MBTS
IUPAC Name: 2-(1,3-benzothiazol-2-yldisulfanyl)-1,3-benzothiazole | CAS Registry Number: 120-78-5
Synonyms: Altax, Thiofide, Pneumax DM, Vulcafor MBTS, Vulkacit DM, Ekagom GS, Accel TM, Vulkacit DM/C, Royal MBTS, Benzothiazyl disulfide, Vulkacit dm/mgc, MBTS disulfide, Dibenzothiazyl disulfide, Benzothiazole disulfide, Dibenzthiazyl disulfide, Naugex MBT, Benzothiazolyl disulfide, MBTS rubber accelerator, Benzthiazole disulfide, Dithiobis(benzothiazole)

Molecular Formula: C14H8N2S4Molecular Weight: 332.486720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AFZSMODLJJCVPP-UHFFFAOYSA-N

• Meldrum's acid
IUPAC Name: 2,2-dimethyl-1,3-dioxane-4,6-dione | CAS Registry Number: 2033-24-1
Synonyms: Isopropylidene malonate, 2,2-Dimethyl-1,3-dioxane-4,6-dione, cycl-Isopropylidene malonate, 1,3-Dioxane-4,6-dione, 2,2-dimethyl-, Cyclic isopropylidene malonate, 2,2-Dimethyl-4,6-dioxo-m-dioxane, 2,2-Dimethyl-m-dioxane-4,6-dione, 210145_ALDRICH, Malonic acid, cyclic isopropylidene ester, EINECS 217-992-8, NSC 71902, NSC688343, AIDS150666, AIDS-150666, NSC71902, BRN 0117310, ZINC01697324, m-DIOXANE-4,6-DIONE, 2,2-DIMETHYL-, AI3-39039, Malonic acid cyclic isopropylidene ester

Molecular Formula: C6H8O4Molecular Weight: 144.125320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: GXHFUVWIGNLZSC-UHFFFAOYSA-N

• Meta Phenylene Diamine (MPDA)
IUPAC Name: benzene-1,3-diamine | CAS Registry Number: 108-45-2
Synonyms: m-Phenylenediamine, m-Diaminobenzene, 3-Aminoaniline, m-Aminoaniline, m-Benzenediamine, Developer C, Developer H, Developer M, 1,3-BENZENEDIAMINE, 1,3-Diaminobenzene, Direct Brown BR, Direct Brown GG, 1,3-Phenylenediamine, Developer 11, 3-Phenylenediamine, Benzenediamine, Diaminobenzene, Metaphenylenediamine, meta-Aminoaniline, m-Fenylendiamin

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WZCQRUWWHSTZEM-UHFFFAOYSA-N

• Methanone, (2,5-dichlorophenyl)phenyl-
IUPAC Name: (2,5-dichlorophenyl)-phenylmethanone | CAS Registry Number: 16611-67-9
Synonyms: 2,5-Dichlorobenzophenone, (2,5-dichlorophenyl)(phenyl)methanone, SBB068331, PubChem7484, AC1L9XYF, SureCN230930, CTK0H4514, 2,5-dichlorophenyl phenyl ketone, MolPort-000-153-950, (2,5-dichlorophenyl)phenylmethanone, ANW-74356, WTI-10736, ZINC02571857, (2,5-dichlorophenyl)-phenylmethanone, AKOS009338708, AG-E-15674, (2,5-dichloro-phenyl)-phenyl-methanone, (2,5-dichlorophenyl)-(phenyl)methanone, methanone, (2,5-dichlorophenyl)phenyl-, AK-59936

Molecular Formula: C13H8Cl2OMolecular Weight: 251.108020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: FAVKIHMGRWRACA-UHFFFAOYSA-N

• Methimazole
IUPAC Name: 3-methyl-1H-imidazole-2-thione | CAS Registry Number: 60-56-0
Synonyms: methimazole, thiamazole, Mercazolyl, Mercazole, Tapazole, Mercaptazole, Merkazolil, Methimazol, Metothyrin, Metothyrine, Thymidazol, Thymidazole, Strumazol, Thiamazol, Favistan, Metazolo, Danantizol, Frentirox, Mercasolyl, Merkastan

Molecular Formula: C4H6N2SMolecular Weight: 114.168840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: PMRYVIKBURPHAH-UHFFFAOYSA-N

• Methoxydienone
IUPAC Name: (8R,9S,13S,14S)-13-ethyl-3-methoxy-4,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-one | CAS Registry Number: 2322-77-2
Synonyms: EINECS 228-351-7, EINECS 219-034-4, CID102242, (1)-13-Ethyl-3-methoxygona-2,5(10)-dien-17-one, 13-beta-Ethyl-3-methoxygona-2,5(10)-dien-17-one, 6236-40-4

Molecular Formula: C20H28O2Molecular Weight: 300.435120 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PQMRKLSVUBRLLQ-XSYGEPLQSA-N

• Methyl (2R,3S)-N-Boc-3-Phenylisoserine
IUPAC Name: methyl 2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate | CAS Registry Number: 124605-42-1
Synonyms: ACMC-209w9x, AGN-PC-001TOB, SureCN12069800, (2R,3S)-N-tert-butoxycarbonyl-3-phenyl-isoserine methyl ester, Benzenepropanoic acid, b-[[(1,1-dimethylethoxy)carbonyl]amino]-a-hydroxy-, methyl ester, (aR,bS)-, AKOS015889287, ST51051647, A805263, I01-1936, Methyl (2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-3-phenylpropionate, 2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanoic acid methyl ester, methyl 2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate, methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-3-phenyl-propanoate

Molecular Formula: C15H21NO5Molecular Weight: 295.330940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: NCALQERIBRYGOK-UHFFFAOYSA-N

• Methyl 1-methyl-2-pyrroleacetate
IUPAC Name: methyl 2-(1-methylpyrrol-2-yl)acetate | CAS Registry Number: 51856-79-2
Synonyms: Methyl 1-methylpyrrol-2-acetate, Methyl 1-methyl-1H-pyrrole-2-acetate, EINECS 257-478-0, ZINC00156541, 1H-Pyrrole-2-acetic acid, 1-methyl-, methyl ester, ST5308364, TL8006329, InChI=1/C8H11NO2/c1-9-5-3-4-7(9)6-8(10)11-2/h3-5H,6H2,1-2H

Molecular Formula: C8H11NO2Molecular Weight: 153.178440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CGYVDYLHQYNGFC-UHFFFAOYSA-N

• Methyl D-(+)-lactate
IUPAC Name: methyl 2-hydroxypropanoate | CAS Registry Number: 17392-83-5
Synonyms: DL-Methyl lactate, METHYL LACTATE, Methyl 2-hydroxypropanoate, Methyl DL-lactate, Lactic acid, methyl ester, (+-)-Methyl lactate, Methyl (R)-lactate, Methyl 2-hydroxypropionate, Methyl alpha-hydroxypropionate, NCIOpen2_003771, HSDB 5687, (+-)-Methyl 2-hydroxypropanoate, (+-)-Methyl 2-hydroxypropionate, 69822_FLUKA, EINECS 208-930-0, EINECS 218-449-8, Propanoic acid, 2-hydroxy-, methyl ester, 2-Hydroxypropanoic acid methyl ester, NSC 406248, EINECS 241-420-6

Molecular Formula: C4H8O3Molecular Weight: 104.104520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LPEKGGXMPWTOCB-UHFFFAOYSA-N


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