Topharman Shanghai Co Ltd

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Profile: Topharman Shanghai Co Ltd manufactures active pharmaceutical intermediates. Our product includes bumetanide, adapalene, ambazone, aminocarb, antazolin, bicifadine and delavirdine. We also provide doxazosin, exalamide, fenoxazoline, fluoxetine, tegaserod, zaleplon and zoledronic acid.

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• 3,4-Dimethoxycinnamic acid
IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)prop-2-enoic acid | CAS Registry Number: 14737-89-4
Synonyms: Dimethyl caffeic acid, Dimethylcaffeic acid, Caffeic acid dimethyl ether, Spectrum5_000142, 3,4-DIMETHOXYCINNAMIC ACID, 3, 4-Dimethoxycinnamic acid, BSPBio_001672, SPECTRUM210567, MLS000570053, D133809_ALDRICH, SPECTRUM1505130, NSC4323, ARONIS023564, Cinnamic acid, 3,4-dimethoxy-, AIDS021439, AIDS-021439, ALBB-004705, NSC43569, (E)-3',4'-Dimethoxycinnamic acid, EINECS 238-801-4

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HJBWJAPEBGSQPR-GQCTYLIASA-N

• 3-Amino-4-(cyclohexylamino) benzoic acid methyl ester
IUPAC Name: methyl 3-amino-4-(cyclohexylamino)benzoate | CAS Registry Number: 503859-27-6
Synonyms: Methyl 3-amino-4-(cyclohexylamino)benzoate, Benzoic acid, 3-amino-4-(cyclohexylamino)-, methyl ester, AC1N39MI, SureCN5065680, BEN137, CTK4J2559, MolPort-007-926-778, HMS1646A21, AKOS001585686, AG-F-69440, MB13523, MCULE-3949320547, KB-180599, 3-amino-4-(cyclohexylamino)benzoic acid methyl ester, Benzoic acid,3-amino-4-(cyclohexylamino)-, methyl ester, 3-AMINO-4-(CYCLOHEXYLAMINO) BENZOIC ACID METHYL ESTER, 3-AMINO-4-(CYCLOHEXYLAMINO) BENZOIC ACID METHYL ESTER;Benzoic acid, 3-amino-4-(cyclohexylamino)-,methyl ester

Molecular Formula: C14H20N2O2Molecular Weight: 248.320800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QZHHJKXBIHAXTB-UHFFFAOYSA-N

• 5-Norbonene-2,3-dicarboximide
Synonyms: Norendimide, Oprea1_059544, 5-Norbornene-2,3-dicarboximide, NSC31977, NSC31978, NSC53245, 5-Norbornene-2,3-dicarboximide, cis-endo-, 5-Norbornene-endo-2,3-dicarboximide, NSC147237, STK246607, 3,6-Endomethylenetetrahydrophthalimide, NSC 147237, NCGC00160680-01, Norborn-5-ene-2,3-cis-exo-dicarboximide, Bicyclo(2.2.1)hept-5-ene-2,3-dicarboximide, K 2154, K-2154, cis-3,6-Endomethylene-delta4-tetrahydrophthalimide, 3,6-Endomethylene-4-cyclohexene-1,2-dicarboximide, 3,6-Endomethylenephthalimide, 1,2,3,4-tetrahydro-

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GPIUUMROPXDNRH-UHFFFAOYSA-N

• (2-METHYL-2-ALLYL)OXY]PHENYL]-
IUPAC Name: 2-[5-methyl-2-(2-methylprop-2-enoxy)phenyl]benzotriazole | CAS Registry Number: 2170-60-7
Synonyms: BEN047, 2H-Benzotriazole, 2-[5-methyl-2-[(2-methyl-2-propenyl)oxy]phenyl]-

Molecular Formula: C17H17N3OMolecular Weight: 279.336380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: VNFRNMXNICGMAL-UHFFFAOYSA-N

• 2-(2,4-DICHLOROPHENOXY)-
IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-2-(2,4-dichlorophenoxy)acetamide | CAS Registry Number: 353464-92-3
Synonyms: AK-778/12434021, N-[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-2-(2,4-dichlorophenoxy)acetamide, AC1LW9LG, Oprea1_675271, ACE021, MolPort-002-818-640, ZINC02056959, MCULE-7412265808, Acetamide, N-[3-(2-benzothiazolyl)-4-chlorophenyl]-2-(2,4-dichlorophenoxy)-

Molecular Formula: C21H13Cl3N2O2SMolecular Weight: 463.764120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LSFNAWVRYMFJBA-UHFFFAOYSA-N

• 2-Chloro-3-amino-4-(2-methylpropylamino)quinoline
IUPAC Name: 2-chloro-4-N-(2-methylpropyl)quinoline-3,4-diamine | CAS Registry Number: 133860-76-1
Synonyms: 2-Chloro-N4-isobutylquinoline-3,4-diamine, 3,4-Quinolinediamine, 2-chloro-N4-(2-methylpropyl)-, 3,4-Quinolinediamine,2-chloro-N4-(2-methylpropyl)-, 2-chloro-3-amino-4-[N-(2-methylpropyl)]amino quinoline, ACMC-209v5v, AGN-PC-00FC2E, QUI017, Jsp002062, CTK4B8836, MolPort-005-937-268, ANW-44657, ZINC21989216, AKOS015914452, AG-D-69045, AC-18442, AK-58159, KB-169516, KB-180521, FT-0643207, A806692

Molecular Formula: C13H16ClN3Molecular Weight: 249.739240 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JARNINMUMFRNPS-UHFFFAOYSA-N

• 3,5-Bis(1,1-Dimethylethyl)-2-Hydroxy-Benzaldehyde (CAS: 37942-04-7)
• 3,5-Di-tert-butyl-2-hydroxybenzaldehyde
IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzaldehyde | CAS Registry Number: 37942-07-7
Synonyms: 140414_ALDRICH, STOCK1S-62613, 3,5-Di-tert-butylsalicylaldehyde, ZINC00056444, 3,5-ditert-butyl-2-hydroxybenzaldehyde, Benzaldehyde, 2-hydroxy, 3,5-di(t-butyl), TL8002784, 3,5-Bis(1,1-dimethylethyl)-2-hydroxy-benzaldehyde, InChI=1/C15H22O2/c1-14(2,3)11-7-10(9-16)13(17)12(8-11)15(4,5)6/h7-9,17H,1-6H

Molecular Formula: C15H22O2Molecular Weight: 234.333980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RRIQVLZDOZPJTH-UHFFFAOYSA-N

• 4,5-Dihydroxy Phthalonitrile
IUPAC Name: 4,5-dihydroxybenzene-1,2-dicarbonitrile | CAS Registry Number: 300853-66-1
Synonyms: 4,5-dihydroxyphthalonitrile, 4,5-DIHYDROXY-1,2-BENZENEDICARBONITRILE, 1,2-benzenedicarbonitrile, 4,5-dihydroxy-, PubChem19792, AC1LD74G, SureCN1852436, 4,5-dihydroxy phthalonitrile, BEN005, CTK8C1001, ANW-65695, AKOS006290209, 4,5-dihydroxybenzene-1,2-dicarbonitrile, AK-89395, EN001529, KB-188062, InChI=1/C8H4N2O2/c9-3-5-1-7(11)8(12)2-6(5)4-10/h1-2,11-12

Molecular Formula: C8H4N2O2Molecular Weight: 160.129560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YOFFYWYKQYCONO-UHFFFAOYSA-N

• 5-fluoroquinoline
IUPAC Name: 5-fluoroquinoline | CAS Registry Number: 394-69-4
Synonyms: 5-Fluoroquinoline, Quinoline, 5-fluoro-, CCRIS 2890, BRN 0114550, EC-000.1483, LS-141957, 5-20-07-00311 (Beilstein Handbook Reference), InChI=1/C9H6FN/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1-6

Molecular Formula: C9H6FNMolecular Weight: 147.149043 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WMFXCDGQRHJFKL-UHFFFAOYSA-N

• 4,5-Dimethyl-1,3-dioxol-2-one
IUPAC Name: 4,5-dimethyl-1,3-dioxol-2-one | CAS Registry Number: 37830-90-3
Synonyms: 1,3-Dioxol-2-one,4,5-dimethyl-, CID142210, 1,3-Dioxol-2-one, 4,5-dimethyl-, ST076813, TL8002780

Molecular Formula: C5H6O3Molecular Weight: 114.099340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QYIOFABFKUOIBV-UHFFFAOYSA-N

• 5-(Bromomethyl)-alpha,alpha,alpha,alpha-tetramethyl-1,3-benzenediacetonitrile
IUPAC Name: 2-[3-(bromomethyl)-5-(2-cyanopropan-2-yl)phenyl]-2-methylpropanenitrile | CAS Registry Number: 120511-84-4
Synonyms: 3,5-bis(2-cyanoprop-2-yl)benzyl bromide, SBB054914, 2-[3-(bromomethyl)-5-(1-cyano-1-methylethyl)phenyl]-2-methylpropanenitrile, 5-bromomethyltetramethyl-1,3-benzenediacetonitrile, 2,2'-(5-(Bromomethyl)-1,3-phenylene)bis(2-methylpropanenitrile), 5-(Bromomethyl)-a,a,a ,a -tetramethyl-1,3-benzenediacetonitrile, zlchem 553, PubChem14362, AGN-PC-00ATFA, SureCN2258695, CTK7C5027, ZLC0418, MolPort-005-935-643, ANW-46630, ZINC21986320, AKOS015889686, AC-6804, AG-B-88288, 3,5-bis(2-cyanoprop-2-yl)benzylbromide, AK-56336

Molecular Formula: C15H17BrN2Molecular Weight: 305.212880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: IHXHGCDOJLOZML-UHFFFAOYSA-N

• 1,1',1'',1'''-(Oxydimethylidyne)Tetrakis Benzene
IUPAC Name: [benzhydryloxy(phenyl)methyl]benzene | CAS Registry Number: 574-42-5
Synonyms: Benzhydrol ether, Benzhydryl ether, Benzohydrol ether, Dibenzhydryl ether, Dibenzohydryl ether, Diphenylmethyl ether, Bis(benzhydryl) ether, Bis(diphenylmethyl) ether, Benzene, 1,1',1'',1'''-(oxydimethylidyne)tetrakis-, Ether, bis(diphenylmethyl), SureCN127629, AC1L1X3Y, BEN077, NSC2438, Ether, bis(diphenylmethyl) (8CI), [benzhydryloxy(phenyl)methyl]benzene, NSC 2438, NSC-2438, 1,1',1'-Tetraphenyldimethyl ether, 1,1,1',1'-Tetraphenyldimethyl ether

Molecular Formula: C26H22OMolecular Weight: 350.452280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PVQATPQSBYNMGE-UHFFFAOYSA-N

• 1-METHALLYL-2-(2-HYDROXY-5-METHYL PHENYL) BENZOTRIAZOLE
IUPAC Name: 4-methyl-2-[3-(2-methylprop-2-enyl)-1H-benzotriazol-2-yl]phenol | CAS Registry Number: 98809-58-6
Synonyms: SureCN3181799, CTK5I0078, AKOS016010462, AG-I-00387, AK117234, 4-Methyl-2-(1-(2-methylallyl)-1H-benzo[d][1,2,3]triazol-2(3H)-yl)phenol

Molecular Formula: C17H19N3OMolecular Weight: 281.352260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GAXSBDZDZCJXCG-UHFFFAOYSA-N

• 4-(2-Aminoethyl)-2(1H)-pyridinone dihydrobromide
IUPAC Name: 4-(2-aminoethyl)-1H-pyridin-2-one;dihydrobromide | CAS Registry Number: 170026-03-6
Synonyms: SureCN2025879, 4-(2-AMINOETHYL)-2(1H)-PYRIDINONE DIHYDROBROMIDE

Molecular Formula: C7H12Br2N2OMolecular Weight: 299.990980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: APANOJAEBUPKME-UHFFFAOYSA-N

• 2-Hydroxy-5-Nitro Pyridine
IUPAC Name: 5-nitro-1H-pyridin-2-one | CAS Registry Number: 5418-51-9
Synonyms: 2-Hydroxy-5-nitropyridine, 5-Nitro-2-pyridinol, 5-Nitro-2-pyridol, 5-Nitropyridin-2-ol, 5-Nitro-2-hydroxypyridine, 5-(nitro)pyridin-2-ol, H48808_ALDRICH, 2(1H)-Pyridinone, 5-nitro-, NSC9454, AIDS020483, AIDS-020483, NSC10478, EINECS 226-525-7, NSC165495, SBB004167, ZINC00333253, H119, AI3-19235, ST5208948, TL8003557

Molecular Formula: C5H4N2O3Molecular Weight: 140.096860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: XKWSQIMYNVLGBO-UHFFFAOYSA-N

• 2-Pyridinesulfonamide, 3-Methyl-
IUPAC Name: 3-methylpyridine-2-sulfonamide | CAS Registry Number: 65938-79-6
Synonyms: 3-methylpyridine-2-sulfonamide, 3-METHYL-2-PYRIDINESULFONAMIDE, SureCN3636398, PYR056, CTK8C1000, 2-Pyridinesulfonamide, 3-methyl-, MolPort-004-759-731, ANW-65687, ZINC21982256, AKOS010113934, AK-89406, EN001602

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

InChIKey: ZOEZYLUVSDCJLS-UHFFFAOYSA-N

• 4-Nitrophenethyl bromide
IUPAC Name: 1-(2-bromoethyl)-4-nitrobenzene | CAS Registry Number: 5339-26-4
Synonyms: p-Nitrophenethyl bromide, 4-nitrophenyl-ethyl-bromide, 1-(2-Bromoethyl)-4-nitrobenzene, 2-(4-Nitrophenyl)ethyl bromide, 4-(2-Bromoethyl)nitrobenzene, .beta.-(p-Nitrophenyl)ethyl bromide, 115053_ALDRICH, Benzene, 1-(2-bromoethyl)-4-nitro-, 73614_FLUKA, NSC3493, EINECS 226-271-7, NSC100730, ZINC01666812, FS000341, C110057, InChI=1/C8H8BrNO2/c9-6-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5-6H, NPB

Molecular Formula: C8H8BrNO2Molecular Weight: 230.058620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NTURQZFFJDCTMZ-UHFFFAOYSA-N

• 1-Chlorodiethyl carbonate
IUPAC Name: 1-chloroethyl ethyl carbonate | CAS Registry Number: 50893-36-2
Synonyms: 1-Chloroethyl ethyl carbonate, 23030_FLUKA, EINECS 256-832-1, Carbonic acid, 1-chloroethyl ethyl ester

Molecular Formula: C5H9ClO3Molecular Weight: 152.576160 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YVRGKFXJZCTTRB-UHFFFAOYSA-N

• (DIBENZYL)THIO]-ACETIC ACID ETHYL ESTER
IUPAC Name: ethyl 2-benzhydrylsulfanylacetate | CAS Registry Number: 63547-23-9
Synonyms: ethyl 2-[(diphenylmethyl)sulfanyl]acetate, SureCN5273905, ACE029, ethyldiphenylmethylsulfanylacetate, CTK8E5824, MolPort-003-846-966, ZINC22058198, AKOS015840558, AG-G-36072, RP15670, ethyl 2-(diphenylmethyl)sulfanylethanoate, FT-0667669, 2-[(diphenylmethyl)thio]acetic acid ethyl ester, A834411, Acetic acid, [(diphenylmethyl)thio]-, ethylester, Aceticacid, [(diphenylmethyl)thio]-, ethyl ester (9CI);

Molecular Formula: C17H18O2SMolecular Weight: 286.388620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: USHWCUHXXAVVLF-UHFFFAOYSA-N

• 1-Cyclohexyl-2-(3-furanyl)-1H-benzimidazole-5-carboxylic acid
IUPAC Name: 1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carboxylic acid | CAS Registry Number: 390811-95-7
Synonyms: 1-CYCLOHEXYL-2-(3-FURANYL)-1H-BENZIMIDAZOLE-5-CARBOXYLIC ACID, 1-cyclohexyl-2-(3-furyl)-1h-benzimidazole-5-carboxylic acid, 1-cyclohexyl-2-(furan-3-yl)benzimidazole-5-carboxylic acid, 1H-Benzimidazole-5-carboxylic acid, 1-cyclohexyl-2-(3-furanyl)-, AC1LAMC8, SureCN5110455, AC1Q5V53, BEN031, CHEMBL175177, CTK1C1953, CHEBI:393330, AR-1C2547, AG-J-93427, A824400, 1-cyclohexyl-2-(3-furanyl)-5-benzimidazolecarboxylic acid, 1-cyclohexyl-2-(furan-3-yl)-1H-benzo[d]imidazole-5-carboxylic acid, 1H-Benzimidazole-5-carboxylicacid, 1-cyclohexyl-2-(3-furanyl)-

Molecular Formula: C18H18N2O3Molecular Weight: 310.347120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JTLQUCGDQKGJMM-UHFFFAOYSA-N

• 7-Methyl-2-Propyl-1h-Benzoimidazole-5-Carboxylic Acid Methyl Ester
IUPAC Name: methyl 7-methyl-2-propyl-3H-benzimidazole-5-carboxylate | CAS Registry Number: 152628-00-7
Synonyms: Methyl 4-methyl-2-propyl-1H-benzimidazole-6-carboxylate, Methyl 7-methyl-2-propyl-1H-benzo[d]imidazole-5-carboxylate, zlchem 379, 2-IODTHIOPHENE, SCHEMBL159894, BEN181, CTK8H0576, ZLC0223, DEFDQXCQBZEOGY-UHFFFAOYSA-N, MolPort-027-835-523, ZINC34279246, AKOS016009584, AC-6374, AJ-87789, AK111137, AN-10110, AB0109328, DB-050274, RT-013837, FT-0659466

Molecular Formula: C13H16N2O2Molecular Weight: 232.278340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DEFDQXCQBZEOGY-UHFFFAOYSA-N

• 4-Anilino-1-benzyl-4-cyanopiperidine
IUPAC Name: 4-anilino-1-benzylpiperidine-4-carbonitrile | CAS Registry Number: 968-86-5
Synonyms: Oprea1_077623, Oprea1_583104, MLS000768129, NSC73005, MolPort-001-011-489, ALBB-006604, CID70412, EINECS 213-533-0, STK504026, 4-Anilino-1-benzylpiperidine-4-carbonitrile, SMR000431508, EU-0099857, 1-Benzyl-4-phenylamino-piperidine-4-carbonitrile, 1-benzyl-4-(phenylamino)piperidine-4-carbonitrile, A0707/0032987, Piperidine-4-carbonitrile, 1-benzyl-4-phenylamino-, 4-Piperidinecarbonitrile, 4-(phenylamino)-1-(phenylmethyl)-

Molecular Formula: C19H21N3Molecular Weight: 291.390140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AYYPQRMTCMCFSL-UHFFFAOYSA-N

• 1,4-Dithiothreithol
IUPAC Name: (2S,3S)-1,4-bis(sulfanyl)butane-2,3-diol | CAS Registry Number: 27565-41-9
Synonyms: Dithiothreitol, Sputolysin, dl-Dithiothreitol, Cleland's reagent, rac-Dithiothreitol, 1,4-Dithiothreitol, D-Dtt, Reagents, Cleland's, D-1,4-Dithiothreitol, (+/-)-Dithiothreitol, nchembio.121-comp22, DL-1,4-Dithiothreitol, 1,4-Dithio-dl-threitol, DL-Dithiothreitol solution, DTT (threitol derivative), D9163_SIGMA, D9779_SIGMA, D0632_SIAL, D5545_SIAL, 43815_FLUKA

Molecular Formula: C4H10O2S2Molecular Weight: 154.251000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VHJLVAABSRFDPM-QWWZWVQMSA-N

• 2-Pentylcyclopent-2-En-1-One
IUPAC Name: 2-pentylcyclopent-2-en-1-one | CAS Registry Number: 25564-22-1
Synonyms: Amyl cyclopentenone, 2-Pentyl-2-cyclopenten-1-one, 2-Cyclopenten-1-one, 2-pentyl-, 2-Pentylcyclopent-2-en-1-one, 365343_ALDRICH, EINECS 247-104-4, BRN 1857975, BB_NC-0256, CID117549, ZINC02077861, LS-58373, 4-07-00-00195 (Beilstein Handbook Reference)

Molecular Formula: C10H16OMolecular Weight: 152.233440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ILHZVKAXFCDFMT-UHFFFAOYSA-N

• 2-Amino-6-Ethylpyrimidin-4-Ol
IUPAC Name: 2-amino-6-ethyl-1H-pyrimidin-4-one | CAS Registry Number: 5734-66-7
Synonyms: 2-amino-6-ethylpyrimidin-4-ol, ALBB-005050, CAM032812, STK501565, 2-amino-6-ethyl-1H-pyrimidin-4-one, CID11446372

Molecular Formula: C6H9N3OMolecular Weight: 139.155160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: QDSSWFSXBZSFQO-UHFFFAOYSA-N

• 6,8-Dimethoxynaphthalene-1,3-Diol
IUPAC Name: 6,8-dimethoxynaphthalene-1,3-diol | CAS Registry Number: 64954-45-6
Synonyms: 6,8-dimethoxynaphthalene-1,3-diol, AK135035, EN001285, KB-247447

Molecular Formula: C12H12O4Molecular Weight: 220.221280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XYSLPVXFJXCPJF-UHFFFAOYSA-N

• (1H)-7-(4'-Bromobutoxy)-3,4-dihydro-2-quinolinone
IUPAC Name: 7-(4-bromobutoxy)-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 129722-34-5
Synonyms: 7-(4-Bromobutoxy)-3,4-dihydro-2(1H)-quinolinone, 3,4-Dihydro-7-(4-bromobutoxy)-2(1H)-quinolinone, 7-(4-bromobutoxy)-3,4-dihydro-1H-quinolin-2-one, 7-(4-Bromo-butoxy)-3,4-dihydro-1H-quinolin-2-one, 2(1H)-Quinolinone, 7-(4-bromobutoxy)-3,4-dihydro-, AG-D-60351, 7-(4-bromobutoxy)-3,4-dihydroquinolin-2(1H)-one, PubChem6002, SureCN8513, AGN-PC-0CTILM, ACMC-209bh8, QUI081, Jsp001809, CTK4B6379, MolPort-003-845-324, BB_SC-4613, ANW-19146, BBL011057, STK802231, ZINC15919788

Molecular Formula: C13H16BrNO2Molecular Weight: 298.175640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: URHLNHVYMNBPEO-UHFFFAOYSA-N

• 2-METHOXY-5-NITRO-PYRIMIDIN-4-AMINE
IUPAC Name: 2-methoxy-5-nitropyrimidin-4-amine | CAS Registry Number: 304646-29-5
Synonyms: 2-METHOXY-5-NITRO-4-PYRIMIDINAMINE, ST50983824, AC1MNA5X, PYR109, CTK4G5232, 2-methoxy-5-nitropyrimidin-4-amine, ZINC05174369, 4-Pyrimidinamine,2-methoxy-5-nitro-, 2-Methoxy-5-Nitro-4-Pyrimidinamine;, 2-methoxy-5-nitropyrimidine-4-ylamine, AKOS001012065, 4-Pyrimidinamine, 2-methoxy-5-nitro-, AG-F-00362, KB-231199

Molecular Formula: C5H6N4O3Molecular Weight: 170.126140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: NTYPCKIDOSPATQ-UHFFFAOYSA-N

• [(DIPHENYLMETHYL)SULFINYL]ACETIC ACID ETHYL ESTER
IUPAC Name: ethyl 2-benzhydrylsulfinylacetate | CAS Registry Number: 118286-19-4
Synonyms: ACE027, CTK8E2905, Ethyl 2-(benzhydrylsulfinyl)acetate, AKOS015912331, AK-56573, FT-0667668, [(Diphenylmethyl)sulfinyl]acetic Acid Ethyl Ester, Acetic acid, [(diphenylmethyl)sulfinyl]-,ethyl ester, I14-36756

Molecular Formula: C17H18O3SMolecular Weight: 302.388020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XQVZQTKFGQJNTO-UHFFFAOYSA-N

• 1-benzyl-4-(phenylamino)piperidine-4-carboxylic acid dihydrochloride
IUPAC Name: 4-anilino-1-benzylpiperidine-4-carboxylic acid dihydrochloride | CAS Registry Number: 61379-86-0
Synonyms: MolPort-001-494-958, EINECS 262-744-4, CID3017255, 1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid dihydrochloride

Molecular Formula: C19H24Cl2N2O2Molecular Weight: 383.312060 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: QNDVTIFLVWHAJR-UHFFFAOYSA-N

• 4,5-Diamino-6-Hydroxypyrimidine
IUPAC Name: 5,6-diamino-1H-pyrimidin-4-one | CAS Registry Number: 1672-50-0
Synonyms: 4,5-Diaminohypoxanthine, 4,5-Diamino-6-hydroxypyrimidine, 4-Pyrimidinol, 5,6-diamino-, 5,6-Diamino-4(3H)-pyrimidinone, 4(1H)-Pyrimidinone, 5,6-diamino-, 4(3H)-Pyrimidinone, 5,6-diamino-, NSC36908, NSC 36908, SBB004251, ZINC01669650, 4-Pyrimidinol, 5,6-diamino- (8CI), BBV-00026444, TL8001289, 4(1H)-Pyrimidinone, 5,6-diamino- (9CI), 52502-66-6

Molecular Formula: C4H6N4OMolecular Weight: 126.116640 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: PWRHKLKFADDKHS-UHFFFAOYSA-N

• 2'-Methylbiphenyl-2-Carboxylic Acid
IUPAC Name: 2-(2-methylphenyl)benzoic acid | CAS Registry Number: 7111-77-5
Synonyms: 2-(2-Methylphenyl)benzoic acid, 2'-Methyl-biphenyl-2-carboxylic acid, 2'-methyl-[1,1'-biphenyl]-2-carboxylic acid, SureCN656, ACMC-209ohb, AC1O4ZU5, Ambcb4400422, BIP013, CTK2H6912, 2-(2-Methylphenyl)benzoic acid,, MolPort-000-927-551, 2'-methylbiphenyl-2-carboxylic acid, ANW-35997, AKOS002683501, AG-A-23162, AG-G-78340, BB 0223553, 2'-methyl[1,1'-biphenyl]-2-carboxylic acid, B-3889, [1,1'-Biphenyl]-2-carboxylicacid, 2'-methyl-

Molecular Formula: C14H12O2Molecular Weight: 212.243880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GOAWMKUDICJPHY-UHFFFAOYSA-N

• 1H-Imidazole-1-acetic acid monohydrochloride
IUPAC Name: 2-imidazol-1-ylacetic acid;hydrochloride | CAS Registry Number: 87266-37-3
Synonyms: 1H-Imidazole-1-acetic acid hydrochloride, 2-(1H-imidazol-1-yl)acetic acid hydrochloride, SBB065721, 1H-imidazol-1-ylacetic acid hydrochloride, 1H-Imidazole-1-aceticacid,monohydrochloride, Acetic acid, 2-(1H-imidazol-1-yl) hydrochloride, (1H-Imidazol-1-yl)-acetic acid, zlchem 363, PubChem7609, PubChem8383, AC1Q3F0H, AGN-PC-00KLV9, SureCN1904485, CTK3F0738, 1H-Imidazole-1-acetic acid HCl, ZLC0207, MolPort-003-848-154, ANW-59999, AKOS015892557, Imidazol-1-ylacetic acid hydrochloride

Molecular Formula: C5H7ClN2O2Molecular Weight: 162.574280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JKZJSYXGKHQHRA-UHFFFAOYSA-N

• 7-Amino-1-Methyl-1,2,3,4-Tetrahydroquinoline
IUPAC Name: 1-methyl-3,4-dihydro-2H-quinolin-7-amine | CAS Registry Number: 304690-94-6
Synonyms: ALBB-006390, STK503887, ZINC14000357, CID11217421, ASN 18382305, 1-methyl-1,2,3,4-tetrahydroquinolin-7-amine, 1-methyl-3,4-dihydro-2H-quinolin-7-amine, TL8002349, 7-Amino-N-methyl-1,2,3,4-tetrahydroquinoline, I05-0276

Molecular Formula: C10H14N2Molecular Weight: 162.231560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OMGAOBAAEGMMTF-UHFFFAOYSA-N

• 1H-BENZO[D]IMIDAZOLE-5-METHANOL,6-METHYL-
IUPAC Name: (6-methyl-1H-benzimidazol-5-yl)methanol | CAS Registry Number: 267875-59-2
Synonyms: SureCN7216263, SureCN7220759, BEN035, 1H-Benzimidazole-5-methanol, 6-methyl-

Molecular Formula: C9H10N2OMolecular Weight: 162.188500 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CRRWJCDSJNOVLJ-UHFFFAOYSA-N

• 2-PYRIDINECARBAMIC ACID,5-METHYL-,ETHYL ESTER,1-OXIDE
IUPAC Name: ethyl (NZ)-N-(1-hydroxy-5-methylpyridin-2-ylidene)carbamate | CAS Registry Number: 103860-34-0
Synonyms: AK-55995, 2-((Ethoxycarbonyl)amino)-5-methylpyridine 1-oxide

Molecular Formula: C9H12N2O3Molecular Weight: 196.203180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MXLJQHJSLGVNOM-NTMALXAHSA-N

• 4-Isobutylamino-3-NitroQUINOLINE
IUPAC Name: N-(2-methylpropyl)-3-nitroquinolin-4-amine | CAS Registry Number: 99009-85-5
Synonyms: 4-Isobutylamino-3-nitroquinoline, N-Isobutyl-3-nitroquinolin-4-amine, N-(2-methylpropyl)-3-nitro-4-quinolinamine, N-(2-methylpropyl)-3-nitro-quinolin-4-amine, SureCN4726732, QUI030, CTK5I0169, MolPort-005-935-478, ANW-63207, N-isobutyl-3-nitro-quinolin-4-amine, STL278948, ZINC21986080, AKOS015962064, AG-I-00765, MCULE-6016046759, AK-87943, KB-192901, N-(2-methylpropyl)-3-nitroquinolin-4-amine, 4-Quinolinamine, N-(2-methylpropyl)-3-nitro-, A845942

Molecular Formula: C13H15N3O2Molecular Weight: 245.277100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: CDUWBBGUDMBQDE-UHFFFAOYSA-N

• 1-(3-methylisoxazol-5-yl)ethanone
IUPAC Name: 1-(3-methyl-1,2-oxazol-5-yl)ethanone | CAS Registry Number: 55086-61-8
Synonyms: ZINC26506537, EN001268

Molecular Formula: C6H7NO2Molecular Weight: 125.125280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MOBMLOWIGFJSCP-UHFFFAOYSA-N

• 2-Pyridinamine, 5-(1-methylethyl)-
IUPAC Name: 5-propan-2-ylpyridin-2-amine | CAS Registry Number: 603310-75-4
Synonyms: 5-isopropylpyridin-2-amine, 2-Amino-5-isopropylpyridine, 5-(1-METHYLETHYL)-2-PYRIDINAMINE, SureCN83975, AGN-PC-01NK88, PYR044, CTK8C5048, MolPort-004-756-261, 2-Pyridinamine,5-(1-methylethyl)-, ANW-73858, WTI-10029, AKOS013200984, QC-4961, RP20289, AK-81363, BR-81363, EN001524, KB-69591, W7287, A15678

Molecular Formula: C8H12N2Molecular Weight: 136.194280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GXSWKKZGLOYAPE-UHFFFAOYSA-N

• (1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
IUPAC Name: (1S,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride | CAS Registry Number: 675126-10-0
Synonyms: MolPort-005-943-938, EN000136

Molecular Formula: C16H16Cl3NMolecular Weight: 328.663940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: YKXHIERZIRLOLD-RISSCEEYSA-N

• 5-Amino-2-Methyl-4(1h)-Pyrimidinone
IUPAC Name: 5-amino-2-methyl-1H-pyrimidin-6-one | CAS Registry Number: 53135-22-1
Synonyms: 5-Amino-2-methyl-4(1H)-pyrimidinone, 5-amino-2-methylpyrimidin-4(3H)-one, PubChem2081, SureCN10996697, PYR087, CTK4J7117, MolPort-000-001-227, ANW-57453, SBB069820, ZINC20387787, AKOS006331057, AKOS015892549, 5-amino-2-methyl-1H-pyrimidin-6-one, 5-amino-2-methylpyrimidin-4(1H)-one, AG-F-81911, 5-azanyl-2-methyl-1H-pyrimidin-6-one, 4(3H)-Pyrimidinone,5-amino-2-methyl-, 4(1H)-Pyrimidinone, 5-amino-2-methyl-, AK-87012, EN001614

Molecular Formula: C5H7N3OMolecular Weight: 125.128580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AIFSFPXTFOBDNI-UHFFFAOYSA-N

• 4-Hydroxy-3-nitroquinoline
IUPAC Name: 3-nitro-1H-quinolin-4-one | CAS Registry Number: 50332-66-6
Synonyms: 3-Nitro-4-quinolinol, Maybridge1_006505, 4-Quinolinol, 3-nitro-, Oprea1_311502, Oprea1_563997, 3-nitroquinolin-4(1H)-one, MLS000586691, ZERO/003102, NSC246074, NSC299179, RH 00840, SMR000208070, LS-142568, TL8003336, VC8137500

Molecular Formula: C9H6N2O3Molecular Weight: 190.155540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ZWISCKSGNCMAQO-UHFFFAOYSA-N

• 2-(Chloromethyl)-4,5-dihydro-1H-imidazole Hydrochloride
IUPAC Name: 2-(chloromethyl)-4,5-dihydro-1H-imidazole hydrochloride | CAS Registry Number: 13338-49-3
Synonyms: NSC187479

Molecular Formula: C4H8Cl2N2Molecular Weight: 155.025720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GHCCHMFFNHOXEU-UHFFFAOYSA-N

• 4-HYDROXY-6-METHYL-2H-PYRANO[3,2-C]QUINOLINE-2,5(6H)-DIONE
IUPAC Name: 4-hydroxy-6-methylpyrano[3,2-c]quinoline-2,5-dione | CAS Registry Number: 18706-63-3
Synonyms: SBB038916, 2-hydroxy-6-methyl-4h-pyrano[3,2-c]quinoline-4,5(6h)-dione, AC1LDWJU, Maybridge1_002054, AC1Q6L2A, SureCN2421698, Oprea1_591620, PYR039, CTK4D9404, HMS547F08, MolPort-000-480-827, AR-1E2479, STL217223, AKOS000267091, AKOS015859996, AG-E-36157, MCULE-4978578751, ST096488, 2-hydroxy-6-methylpyrano[3,2-c]quinoline-4,5-dione, I14-36639

Molecular Formula: C13H9NO4Molecular Weight: 243.214860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JLMOERHCVYAGDG-UHFFFAOYSA-N

• 1-Methyl-3-Nitrophthalate
IUPAC Name: 2-methoxycarbonyl-6-nitrobenzoic acid | CAS Registry Number: 21606-04-2
Synonyms: 2-(methoxycarbonyl)-6-nitrobenzoic acid, 1-Methyl-3-nitrophthalate, 3-nitro-2-Carboxyl methyl benzoate, ST50170924, 1,2-Benzenedicarboxylicacid, 3-nitro-1-methylester, AC1NACBV, SureCN2598194, BEN007, Jsp004386, CTK8C0052, Methyl 2-carboxy-3-nitrobenzoate, methyl 3-nitro-2-carboxylbenzoate, MolPort-000-519-133, ANW-63954, RW3124, 2-methoxycarbonyl-6-nitrobenzoic acid, 3-Nitro-phthalic acid 1-Methyl ester, AKOS002268896, 2-Nitro-6-methoxycarbonyl benzoic acid, AC-4830

Molecular Formula: C9H7NO6Molecular Weight: 225.154980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: DJMQLZPEBHSABD-UHFFFAOYSA-N

• 5-Fluoro-8-Nitro Quinoline
IUPAC Name: 5-fluoro-8-nitroquinoline | CAS Registry Number: 152167-85-6
Synonyms: 5-Fluoro-8-nitroquinoline, Quinoline, 5-fluoro-8-nitro-, MolPort-006-708-158, CID153972

Molecular Formula: C9H5FN2O2Molecular Weight: 192.146603 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VUOBTOAOYYTUMC-UHFFFAOYSA-N

• 4-Methyl Cinnamic Acid
IUPAC Name: (E)-3-(4-methylphenyl)prop-2-enoic acid | CAS Registry Number: 1866-39-3
Synonyms: 4-Methylcinnamic acid, p-Methylcinnamic acid, trans-p-Methylcinnamic acid, M35800_ALDRICH, ARONIS003023, NSC66272, EINECS 217-479-9, CID731767, NSC 66272, SBB015822, IDI1_007649, M105, 4-Methylcinnamic acid, predominantly trans, 3-(4-METHYLPHENYL)-2-PROPENOIC ACID

Molecular Formula: C10H10O2Molecular Weight: 162.185200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RURHILYUWQEGOS-VOTSOKGWSA-N

• 6-chloro-2-methyl-5-nitropyrimidin-4(3H)-one
IUPAC Name: 6-chloro-2-methyl-5-nitro-1H-pyrimidin-4-one | CAS Registry Number: 82779-50-8
Synonyms: MolPort-006-728-074, EN001280

Molecular Formula: C5H4ClN3O3Molecular Weight: 189.556560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JQKZPYLOKMRABP-UHFFFAOYSA-N

• 2-Hydroxy-5-nitropyridine (CAS: 5418-54-9)

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