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Topharman Shanghai Co Ltd

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Web: http://www.topharman.com
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Address: Building 1, No.388 Jialilue Road, Zhangjiang Hitech Park, Pudong, Shanghai 201203, China
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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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• 1H-BENZO[D]IMIDAZOLE-5-CARBOXYLIC ACID 6-METHYL-
IUPAC Name: 6-methyl-1H-benzimidazole-5-carboxylic acid | CAS Registry Number: 10351-76-5
Synonyms: SureCN1871362, SureCN7220977, BEN033, CTK0G9489, AG-D-14459, MCULE-9767714156, KB-154680, 1h-benzimidazole-5-carboxylic acid,6-methyl-, 1H-Benzimidazole-5-carboxylicacid, 6-methyl-, 1H-Benzimidazole-6-carboxylicacid, 5-methyl-, 1H-Benzimidazole-5-carboxylicacid, 6-methyl- (9CI); 5-Benzimidazolecarboxylic acid, 6-methyl- (8CI)

Molecular Formula: C9H8N2O2Molecular Weight: 176.172020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZHZZGQXASQPFLC-UHFFFAOYSA-N

• 4-(phenylamino)-1-(phenylmethyl)piperidine-4-carboxylic acid
IUPAC Name: 4-(anilino)-1-(phenylmethyl)piperidine-4-carboxylic acid | CAS Registry Number: 85098-64-2
Synonyms: NSC73748, NCIStruc1_001410, NCIStruc2_001530, Oprea1_065627, Oprea1_466880, AIDS125477, AIDS-125477, CID43544, NCI73748, EINECS 285-415-7, NCGC00013811, NSC 73748, NSC-73748, NCGC00096921-01, NCI60_041615, 4-Anilino-1-benzyl-4-piperidinecarboxylic acid, T001349, 1-Benzyl-4-(phenylamino)piperidine-4-carboxylic acid, 6382-34-9

Molecular Formula: C19H22N2O2Molecular Weight: 310.390180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YFSCBWDAVTYIMM-UHFFFAOYSA-N

• 4-formyl-3-hydroxybenzonitrile
IUPAC Name: 3-hydroxy-4-methylbenzonitrile | CAS Registry Number: 3816-66-8
Synonyms: 3-Hydroxy-4-methylbenzonitrile, MolPort-001-786-793, EC-000.1787, EN001617

Molecular Formula: C8H7NOMolecular Weight: 133.147280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UXNPMDKLHYMKBZ-UHFFFAOYSA-N

• 4-Amino-6-chloro-2-methylpyrimidine
IUPAC Name: 6-chloro-2-methylpyrimidin-4-amine | CAS Registry Number: 1749-68-4
Synonyms: NSC145903, CID286754

Molecular Formula: C5H6ClN3Molecular Weight: 143.574240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SSAYHQQUDKQNAC-UHFFFAOYSA-N

• 2-Chloro-5-fluoropyrimidine
IUPAC Name: 2-chloro-5-fluoropyrimidine | CAS Registry Number: 62802-42-0
Synonyms: 5-Fluoro-2-chloropyrimidine, 2-Chloro-5-fluoro-pyrimidine, 651753_ALDRICH, FS001041, TL8004270, 3S211020

Molecular Formula: C4H2ClFN2Molecular Weight: 132.523483 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGYUQBNABXVWMS-UHFFFAOYSA-N

• 1,3-Bis(bromomethyl)-5-methylbenzene
IUPAC Name: 1,3-bis(bromomethyl)-5-methylbenzene | CAS Registry Number: 19294-04-3
Synonyms: 3,5-Bis(bromomethyl)toluene, NSC243652, CID316162, ST5409004, TL8001581

Molecular Formula: C9H10Br2Molecular Weight: 277.983700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: AKDWRXXKHRUFMS-UHFFFAOYSA-N

• 1,3-Bis(4-aminophenoxy)benzene
IUPAC Name: 4-[3-(4-aminophenoxy)phenoxy]aniline | CAS Registry Number: 2479-46-1
Synonyms: RODA, Resorcinol oxydianiline, Maybridge3_000438, ChemDiv2_000189, CCRIS 6684, Oprea1_569946, CBDivE_002807, MLS000719868, 4,4'-(m-Phenylenedioxy)dianiline, 476323_ALDRICH, AIDS185674, 1,3-Phenylene-di-4-aminophenyl ether, 1,3-Phenylenedi(4-aminophenyl ether), AIDS-185674, BRN 0423316, ANILINE, p,p'-(m-PHENYLENEDIOXY)DI-, ZINC00135553, 4,4'-(1,3-Phenylenedioxy)dianiline, 4-[3-(4-aminophenoxy)phenoxy]aniline, IDI1_011825

Molecular Formula: C18H16N2O2Molecular Weight: 292.331840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WUPRYUDHUFLKFL-UHFFFAOYSA-N

• 4-OXO-PYRIMIDIN-2-YL)-N,N-DIMETHYL-
IUPAC Name: N,N-dimethyl-N'-(6-methyl-5-nitro-4-oxo-1H-pyrimidin-2-yl)methanimidamide | CAS Registry Number: 151587-54-1
Synonyms: MET004, FT-0667291, Methanimidamide, N'-(1,4-dihydro-6-methyl-5-nitro-4-oxo-2-pyrimidinyl)-N,N-dimethyl-

Molecular Formula: C8H11N5O3Molecular Weight: 225.204640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JHNLMNSDAFLKIB-RUDMXATFSA-N

• 2-(AMINO-ETHOXY-METHYLIDENE)PROPANEDINITRILE
IUPAC Name: 2-[amino(ethoxy)methylidene]propanedinitrile | CAS Registry Number: 6825-53-2
Synonyms: NSC98432, CID263761

Molecular Formula: C6H7N3OMolecular Weight: 137.139280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KDFIDTYCUXJWPU-UHFFFAOYSA-N

• 1H-Pyrrolo[3,2-b]pyridin-5-amine
IUPAC Name: 1H-pyrrolo[3,2-b]pyridin-5-amine | CAS Registry Number: 207849-66-9
Synonyms: 1H-pyrrolo[3,2-b]pyridin-5-amine, 5-amino-4-azaindole, 5-Aminopyrrolo[3,2-b]pyridine, 1h-pyrrolo[3,2-b]pyridin-5-ylamine, 5-Amine-1H-Pyrrolo[3,2-b]pyridin, ACMC-1CFOW, SureCN7007696, PYR022, CTK0J9645, MolPort-004-756-796, ACT04889, ANW-48218, SBB069873, ZINC18617164, AKOS006327964, AB52502, AG-C-78538, AG-E-52581, QC-9172, RP20068

Molecular Formula: C7H7N3Molecular Weight: 133.150580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NOEYQOAKBMZXFX-UHFFFAOYSA-N

• 4-Amino-2-chloro -5-nitro pyrimidine
IUPAC Name: 2-chloro-5-nitropyrimidin-4-amine | CAS Registry Number: 1920-66-7
Synonyms: NSC40838, MolPort-000-002-936, 4-Pyrimidinamine, 2-chloro-5-nitro-, 2-Chloro-5-nitropyrimidin-4-amine, CID74716, 4-Amino-2-chloro-5-nitropyrimidine, EINECS 217-648-7, ZINC04243102, AI3-52033, F1930-0037

Molecular Formula: C4H3ClN4O2Molecular Weight: 174.545220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RZGOEIWDMVQJBQ-UHFFFAOYSA-N

• 5,6-Diamino-4-hydroxy-2-mercaptopyrimidine
IUPAC Name: 5,6-diamino-2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 1004-76-8
Synonyms: 4,5-Diamino-2-thiouracil, 5,6-Diamino-2-thiouracil, D17807_ALDRICH, 4,5-Diamino-6-hydroxy-2-thiopyrimidine, Uracil, 5,6-diamino-2-thio-, ALD-N037856, NSC45759, EINECS 213-727-5, NSC 45759, ZINC00967309, ZINC01081263, 4,5-Diamino-2-mercaptopyrimidin-6-ol, 4,5-Diamino-2-mercaptopyrimidine-6-ol, 4,5-Diamino-6-hydroxy-2-mercaptopyrimidine, AI3-52253, TL8000054, 5,6-diamino-2-sulfanylpyrimidin-4(3H)-one, Uracil, 5,6-diamino-2-thio- (VAN) (8CI), AC-907/25005461, 4(1H)-Pyrimidinone, 5,6-diamino-2,3-dihydro-2-thioxo-

Molecular Formula: C4H6N4OSMolecular Weight: 158.181640 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 3

InChIKey: QYSWOQHLIDKEOL-UHFFFAOYSA-N

• 3-Amino-4-chlorobenzoic Acid 2-Dodecyloxy-1-methyl-2-oxoehylester
IUPAC Name: (1-dodecoxy-1-oxopropan-2-yl) 3-amino-4-chlorobenzoate | CAS Registry Number: 63966-96-1
Synonyms: 3-Amino-4-chlorobenzoic acid 2-dodecyloxy-1-methyl-2-oxoethyl ester, SureCN6161842, BEN138, CTK5C0314, AKOS015915273, AG-G-38908, AC-19526, KB-180619, ST51055398, A834592, I14-6332, 3-amino-4-chlorobenzoic acid (1-dodecoxy-1-oxopropan-2-yl) ester, (1-dodecoxy-1-oxidanylidene-propan-2-yl) 3-azanyl-4-chloranyl-benzoate, 3-Amino-4-chlorobenzoic acid 2-dodecyloxy-1-methyl-2-oxoethyl ester;, Benzoic acid,3-amino-4-chloro-, 2-(dodecyloxy)-1-methyl-2-oxoethyl ester, Benzoic acid, 3-amino-4-chloro-2-(dodecycloxy)-1-methyl-2-oxo-, ethyl ester

Molecular Formula: C22H34ClNO4Molecular Weight: 411.962660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: KVBTUIKKMVJZEF-UHFFFAOYSA-N

• 2-Amino-6-Methyl-5-Nitro-4(3H)-Pyrimidinone
IUPAC Name: 2-amino-6-methyl-5-nitro-1H-pyrimidin-4-one | CAS Registry Number: 4214-85-1
Synonyms: AmbagaB89490, AmbagaB158116, NSC73576, MolPort-000-000-507, CID252219, ZINC17328380, EN000146, 2-Amino-6-methyl-5-nitro-4(3H)-pyrimidinone, M6315, 2-Amino-6-methyl-5-nitro-3H-pyrimidin-4-one, 2-amino-6-methyl-5-nitropyrimidin-4(3H)-one, A44137, 2-Amino-6-methyl-5-nitropyrimidine-4(3H)-one, I03-0328

Molecular Formula: C5H6N4O3Molecular Weight: 170.126140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PFTYCGMGNJVFIX-UHFFFAOYSA-N

• 3-Hydroxypyridine-4-carboxylic acid methyl ester
IUPAC Name: methyl 3-hydroxypyridine-4-carboxylate | CAS Registry Number: 10128-72-0
Synonyms: Methyl 3-hydroxyisonicotinate, AG-D-07854, methyl 3-hydroxypyridine-4-carboxylate, 3-HYDROXYPYRIDINE-4-CARBOXYLIC ACID METHYL ESTER, 4-Pyridinecarboxylicacid, 3-hydroxy-, methyl ester, methylhydroxyisonicotinate, SureCN3028074, KSC499M7B, PYR105, CTK3J9670, methyl 3-hydroxyisonicotinic acid, MolPort-000-004-992, WT643, ACT02432, ANW-47078, CL0150, SBB086891, ZINC08729725, AKOS005070472, MCULE-3539214855

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OJRUFSZEJPZKQV-UHFFFAOYSA-N

• 1-(7H-purin-6-yl)methanamine
IUPAC Name: 7H-purin-6-ylmethanamine | CAS Registry Number: 98141-15-2
Synonyms: EN001290

Molecular Formula: C6H7N5Molecular Weight: 149.153280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FELHYNZKVDMRSU-UHFFFAOYSA-N

• 2-Amino-4-chloro-5-methylbenzenesulfonyl chloride
IUPAC Name: 2-amino-4-chloro-5-methylbenzenesulfonyl chloride | CAS Registry Number: 104613-64-1
Synonyms: 2-AMINO-4-CHLORO-5-METHYLBENZENESULFONYL CHLORIDE, Benzenesulfonylchloride, 2-amino-4-chloro-5-methyl-, 2-Amino-4-chloro-5-methylbenzene-1-sulfonyl chloride, Benzenesulfonyl chloride, 2-amino-4-chloro-5-methyl-, ACMC-1BPW5, AGN-PC-002UC4, BEN118, CTK0H3835, ANW-66374, AKOS015911775, AG-D-17038, AK-55890, KB-227702, 2-Amino-4-chloro-5-methylbenzenesulfonylchloride;, 2-amino-4-chloro-5-methyl benzenesulfonyl chloride, I14-37504

Molecular Formula: C7H7Cl2NO2SMolecular Weight: 240.106980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MZNFQQLADSWLLV-UHFFFAOYSA-N

• 1,3,5-Benzenetricarboxylic Acid
IUPAC Name: benzene-1,3,5-tricarboxylic acid | CAS Registry Number: 554-95-0
Synonyms: Trimesic acid, Trimesinic acid, Trimesitinic acid, 5-Carboxyisophthalic acid, 1,3,5-Tricarboxybenzene, 1,3,5-BENZENETRICARBOXYLIC ACID, Ambap1488, benzene-1,3,5-tricarboxylic acid, NCIOpen2_009462, 482749_ALDRICH, NSC 3998, 92130_FLUKA, CHEBI:46032, EINECS 209-077-7, NSC3998, AIDS018148, AIDS-018148, AI3-06468, LS-195254, TL8003619

Molecular Formula: C9H6O6Molecular Weight: 210.140340 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 6

InChIKey: QMKYBPDZANOJGF-UHFFFAOYSA-N

• 1-PIPERAZINEACETAMIDE,4-(PYRIDIN-2-YL)-
IUPAC Name: 2-(4-pyridin-2-ylpiperazin-1-yl)acetamide | CAS Registry Number: 697282-55-6
Synonyms: ST50835255, 2-[4-(pyridin-2-yl)piperazin-1-yl]acetamide, 2-(4-pyridin-2-ylpiperazin-1-yl)acetamide, AC1O6AJ5, SureCN4405017, PIP006, CTK9A1611, MolPort-002-129-566, HMS1606J12, STK477215, AKOS003331955, MCULE-3368088074, 2-(4-(2-pyridyl)piperazinyl)acetamide, 1-Piperazineacetamide, 4-(2-pyridinyl)-, KB-118634

Molecular Formula: C11H16N4OMolecular Weight: 220.270940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YFPGQTMHZHRFCO-UHFFFAOYSA-N

• 4,6-Dichloro-2,5-dimethylpyrimidine
IUPAC Name: 4,6-dichloro-2,5-dimethylpyrimidine | CAS Registry Number: 1780-33-2
Synonyms: NCIMech_000181, NSC40212, NCI60_003774, TL8001424

Molecular Formula: C6H6Cl2N2Molecular Weight: 177.031240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BXVKGWQEEXPBAW-UHFFFAOYSA-N

• [(Diphenylmethyl)thio]acetamide
IUPAC Name: 2-benzhydrylsulfanylacetamide | CAS Registry Number: 68524-30-1
Synonyms: 2-[(DIPHENYLMETHYL)THIO]ACETAMIDE, Diphenylmethyl Thioacetamide, 2-Benzhydrylsulfanyl-acetamide, 2-[(Diphenylmethyl)thio]-acetamide, AG-G-64065, PubChem19513, SureCN1537233, 2-(Benzhydrylthio)acetamide;, KSC493O9F, ACE003, 2-(Benzhydrylsulphanyl)acetamide, CTK3J3792, MolPort-005-935-534, 2-(diphenylmethyl)sulfanylethanamide, RW2765, ZINC00009766, 2-[(diphenylmethyl)sulfanyl]acetamide, Acetamide, 2-[(diphenylmethyl)thio]-, AKOS015888234, 2-[(Diphenylmethyl)sulphanyl]acetamide

Molecular Formula: C15H15NOSMolecular Weight: 257.350700 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HCRQRIFRHGPWBH-UHFFFAOYSA-N

• 2-Hydroxy-4-methyl-3-nitropyridine
IUPAC Name: 4-methyl-3-nitro-1H-pyridin-2-one | CAS Registry Number: 21901-18-8
Synonyms: 4-Methyl-3-nitro-2-pyridone, 2-Hydroxy-3-nitro-4-picoline, 290114_ALDRICH, NSC402986, CID345370, ZINC00155253, TL8001754

Molecular Formula: C6H6N2O3Molecular Weight: 154.123440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HZCWTTHQRMHIIE-UHFFFAOYSA-N

• 2-Methyl-2H-indazole-3-carboxylic acid
IUPAC Name: 2-methylindazole-3-carboxylic acid | CAS Registry Number: 34252-44-3
Synonyms: 2-methylindazole-3-carboxylic Acid, 2H-Indazole-3-carboxylic acid, 2-methyl-, AC1OEOWM, SureCN1563562, IND008, MolPort-000-143-290, ANW-60854, SBB089157, AKOS006346248, AG-L-63511, CC44401, PB12449, RP02987, AK-79271, BL000192, KB-25231, FT-0671861, Y5387

Molecular Formula: C9H8N2O2Molecular Weight: 176.172020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ABRISPFTOZIXMP-UHFFFAOYSA-N

• (6a,11b,16a,17a)-6,9-Difluoro-11,17-dihydroxy-16-methyl-3-oxoandrosta-1,4-diene-17-carbothioic acid
IUPAC Name: (6S,8S,9R,10S,11S,13S,16R,17R)-6,9-difluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-17-carbothioic S-acid | CAS Registry Number: 80473-92-3
Synonyms: AND009, Androsta-1,4-diene-17-carbothioic acid, 6,9-difluoro-11,17-dihydroxy-16-methyl-3-oxo-,(6|A,11|A,16|A,17|A)-

Molecular Formula: C21H26F2O4SMolecular Weight: 412.490546 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: GLAJUXBOZSWZMM-YTPOTJLPSA-N

• 2,2'-(5-Methyl-1,3-phenylene)di(2-methylpropanenitrile)
IUPAC Name: 2-[3-(2-cyanopropan-2-yl)-5-methylphenyl]-2-methylpropanenitrile | CAS Registry Number: 120511-72-0
Synonyms: 3,5-Bis(2-cyanoprop-2-yl)toluene, Pentamethyl-1,3-benzenediacetonitrile, 2,2'-(5-Methyl-1,3-phenylene)bis(2-methylpropanenitrile), 1,3-Benzenediacetonitrile,a1,a1,a3,a3,5-pentamethyl-, 2,2-(5-Methyl-1-,3-phenylene)di(2-methylpropiononitrile), PubChem14361, ACMC-1C6FE, AGN-PC-00R8FQ, SureCN1172829, CTK4B1911, MolPort-003-985-824, ANW-46631, SBB063217, ZINC21985858, AKOS005257888, AC-6803, AG-D-44789, 3,5-Bis(2-cyano-2-methylethyl)toluene, AK-55794, EN001317

Molecular Formula: C15H18N2Molecular Weight: 226.316820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SJECEXNMZXMXNE-UHFFFAOYSA-N

• 2,3-Dihydroxypyridine
IUPAC Name: 3-hydroxy-1H-pyridin-2-one | CAS Registry Number: 84719-32-4
Synonyms: 2,3-DIHYDROXYPYRIDINE, 2,3-Pyridinediol, Pyridine-2,3-diol, 16867-04-2, 2(1H)-Pyridinone, 3-hydroxy-, 2(1H)-Pyridone, 3-hydroxy-, 3-Hydroxy-2-pyridone, 3-hydroxypyridin-2(1H)-one, 3-Hydroxy-1H-pyridin-2-one, 3-Hydroxy-2(1H)-pyridinone, CHEMBL287899, NSC49272, EINECS 240-887-3, NSC 49272, AI3-61776, 119764-03-3, 3-oxidanyl-1H-pyridin-2-one, 13466-42-7, zlchem 302, PubChem2580

Molecular Formula: C5H5NO2Molecular Weight: 111.098700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: GGOZGYRTNQBSSA-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

• 3,4-Dichlorocinnamic acid
IUPAC Name: (E)-3-(3,4-dichlorophenyl)prop-2-enoic acid | CAS Registry Number: 1202-39-7
Synonyms: 3,4-DICHLOROCINNAMIC ACID, 3',4'-Dichlorocinnamic acid, Cinnamic acid, 3,4-dichloro-, 144703_ALDRICH, EINECS 214-866-4, 2-Propenoic acid, 3-(3,4-dichlorophenyl)-, NSC 518800, BRN 1872129, NSC518800, SBB015056, 3-(3,4-Dichlorophenyl)-2-propenoic acid, Cinnamic acid, 3,4-dichloro- (8CI), LS-123619, InChI=1/C9H6Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2

Molecular Formula: C9H6Cl2O2Molecular Weight: 217.048740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RRLUFPHCTSFKNR-DUXPYHPUSA-N

• 5,6-Dimethoxy-1-Indanone
IUPAC Name: 5,6-dimethoxy-2,3-dihydroinden-1-one | CAS Registry Number: 2107-69-9
Synonyms: 5,6-Dimethoxy-1-indanone, 5,6-Dimethoxyindan-1-one, 147826_ALDRICH, NSC401450, CID75018, EINECS 218-287-8, ZINC00164394, NSC 401450, 1H-Inden-1-one, 2,3-dihydro-5,6-dimethoxy-, ST5308464, TL8001751, InChI=1/C11H12O3/c1-13-10-5-7-3-4-9(12)8(7)6-11(10)14-2/h5-6H,3-4H2,1-2H

Molecular Formula: C11H12O3Molecular Weight: 192.211180 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IHMQOBPGHZFGLC-UHFFFAOYSA-N

• 1-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione
IUPAC Name: 5-(4-methylphenyl)-3-azabicyclo[3.1.0]hexane-2,4-dione | CAS Registry Number: 66504-87-8
Synonyms: MolPort-005-941-792, EN001272

Molecular Formula: C12H11NO2Molecular Weight: 201.221240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XTYDBYBSBXUPEO-UHFFFAOYSA-N

• 1,2,4-Triaminobenzene dihydrochloride
IUPAC Name: benzene-1,2,4-triamine | CAS Registry Number: 615-47-4
Synonyms: 1,2,4-Benzenetriamine, 1,2,4-Triaminobenzene, 1,3,4-Benzenetriamine, 1,3,4-Triaminobenzene, Benzene-1,2,4-triyltriamine, benzene-1,2,4-triamine, CHEBI:29148, EINECS 210-443-3, ZERO/008134, NSC4739, NSC 190394, CID69206, BRN 0636836, NSC190394, ZINC00053658, LS-32201, 4-13-00-00506 (Beilstein Handbook Reference), 615-71-4

Molecular Formula: C6H9N3Molecular Weight: 123.155760 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: JSYBAZQQYCNZJE-UHFFFAOYSA-N

• 5-Amino-6-chloro-2-methyl-4(1H)-pyrimidinone
IUPAC Name: 5-amino-6-chloro-2-methyl-1H-pyrimidin-4-one | CAS Registry Number: 98025-13-9
Synonyms: 5-AMINO-6-CHLORO-2-METHYL-4(1H)-PYRIMIDINONE, PYR088, CTK3I6496, AKOS015892517, AG-H-98630, KB-196692, 4(1H)-Pyrimidinone, 5-amino-6-chloro-2-methyl-, I03-0343

Molecular Formula: C5H6ClN3OMolecular Weight: 159.573640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: ABJJAKRTVUXAEX-UHFFFAOYSA-N

• 3,5-Bis(cyanomethyl)toluene
IUPAC Name: 2-[3-(cyanomethyl)-5-methylphenyl]acetonitrile | CAS Registry Number: 120511-74-2
Synonyms: 5-Methyl-1,3-benzenediacetonitrile, 3,5-bis-(Cyanomethyl)toluene, 1,3-Benzenedicarbonitrile,2,5-dimethyl-, [3-(cyanomethyl)-5-methylphenyl]acetonitrile, 2,2'-(5-Methyl-1,3-phenylene)diacetonitrile, 107170-81-0, PubChem19672, ACMC-20ah11, SureCN2262582, BEN019, CTK4A5037, 5-Methyl-1,3-diacetonitrilbezene, MolPort-003-848-738, 5-Methylbenzene-1,3-diacetonitrile, ANW-72995, SBB068769, ZINC21297549, 1,3-Benzenediacetonitrile, 5-methyl-, AKOS006285190, AC-6805

Molecular Formula: C11H10N2Molecular Weight: 170.210500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: XJCXEUYJQHPEAE-UHFFFAOYSA-N

• 2,4-Dihydroxy-6,7-Dimethoxyquinazoline
IUPAC Name: 6,7-dimethoxy-1H-quinazoline-2,4-dione | CAS Registry Number: 28888-44-0
Synonyms: Oprea1_517280, 329258_ALDRICH, 6,7-Dimethoxyquinazoline-2,4-dione, BB_NC-0679, EINECS 249-288-1, 6,7-Dimethoxy-2,4-quinazolinedione, CID120081, ZINC00120622, NCGC00160264-01, 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione, ST5307686, TL8002279, 6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione

Molecular Formula: C10H10N2O4Molecular Weight: 222.197400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: KWNQIIMVPSMYEM-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

• 5-fluoroquinolin-8-amine
IUPAC Name: 5-fluoroquinolin-8-amine | CAS Registry Number: 161038-18-2
Synonyms: 5-Fluoro-8-quinolinamine, 8-quinolinamine, 5-fluoro-, SureCN11900676, QUI034, MolPort-004-782-500, ANW-66716, SBB070094, ZINC39088977, AKOS006331805, QC-4155, RP22511, AK-27335, KB-197676, FT-0649762, A22980, I08-0125

Molecular Formula: C9H7FN2Molecular Weight: 162.163683 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QDWQDAXFVALXGP-UHFFFAOYSA-N

• 4-Amino-6-hydroxy-2-mercapto-5-nitrosopyrimidine
IUPAC Name: 6-amino-5-nitroso-2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 1672-48-6
Synonyms: 6-Amino-5-nitroso-2-thiouracil, NSC229540, AIDS040680, AIDS-040680, EINECS 216-807-8, EINECS 226-680-0, ZINC04261925, ST5307081, 6-Amino-2-mercapto-5-nitroso-4-pyrimidinol ammoniate, Pyrimidene, 2-thiol, 4-amino, 5-nitroso, 6-hydroxy, 6-Amino-2,3-dihydro-5-nitroso-2-thioxopyrimidin-4(1H)-one, monoammonium salt, 5451-33-2

Molecular Formula: C4H4N4O2SMolecular Weight: 172.165160 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UOWCFGBLAMCSFY-UHFFFAOYSA-N

• 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

• 1-Benzyl-5-ethoxy-2,4-imidazolinedione
IUPAC Name: (5R)-5-ethoxy-1-(phenylmethyl)imidazolidine-2,4-dione | CAS Registry Number: 65855-02-9
Synonyms: ZINC00367637, 2,4-Imidazolidinedione, 5-ethoxy-1-(phenylmethyl)-

Molecular Formula: C12H14N2O3Molecular Weight: 234.251160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FUQZCDCFSMSNBP-LLVKDONJSA-N

• 2-[(Diphenylmethyl)sulfonyl] Acetamide
IUPAC Name: 2-benzhydrylsulfonylacetamide | CAS Registry Number: 118779-53-6
Synonyms: 2-(Benzhydrylsulfonyl)acetamide, 2-[(diphenylmethyl)sulfonyl]acetamide, STK224840, Modafinil Sulfone, ZINC00024705, 2-benzhydrylsulfonylacetamide, SureCN1537325, AC1O5M37, ACE002, MolPort-002-128-194, HMS1604F01, BBL005248, CRL 41056, AKOS004118340, MCULE-1674282340, Acetamide, 2-[(diphenylmethyl)sulfonyl]-, KB-226633, FT-0672445, 2-[(DIPHENYLMETHYL)SULFONYL]-ACETAMIDE

Molecular Formula: C15H15NO3SMolecular Weight: 289.349500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ZESNOWZYHYRSRY-UHFFFAOYSA-N

• (-)-Epicatechin gallate
IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate | CAS Registry Number: 1257-08-5
Synonyms: L-Epicatechin gallate, Epicatechol, gallate, (-)-Epicatechin-3-gallate, Spectrum_000314, SpecPlus_000275, (-)-Epicatechin-3-O-gallate, Spectrum2_000165, Spectrum3_000246, Spectrum4_001540, Spectrum5_000080, Epicatechol, gallate (6CI), BSPBio_001632, KBioGR_001980, KBioSS_000794, SPECTRUM210238, DivK1c_006371, SPBio_000029, E3893_SIAL, MEGxp0_000810, Epicatechol, 3-gallate, (-)-

Molecular Formula: C22H18O10Molecular Weight: 442.372320 [g/mol]
H-Bond Donor: 7H-Bond Acceptor: 10

InChIKey: LSHVYAFMTMFKBA-TZIWHRDSSA-N

• 2-aminopyrrolidine hydrochloride
IUPAC Name: 3,4-dihydro-2H-pyrrol-5-amine;hydrochloride | CAS Registry Number: 7544-75-4
Synonyms: 3,4-Dihydro-2H-pyrrol-5-amine hydrochloride, pyrrolidin-2-imine hydrochloride, 2-AMINO-1-PYRROLINE HYDROCHLORIDE, AC1Q3CKF, SureCN990656, SureCN2831274, CHEMBL543888, CTK7D1289, CTK8B5017, MolPort-002-317-283, MolPort-005-310-923, Pyrrolidin-(2E)-ylideneamine HCl, ANW-47045, AKOS006223432, AG-B-45911, MCULE-6089369366, AK-81762, KB-19603, 3,4-DIHYDRO-2H-PYRROL-5-AMINE HCL, FT-0689912

Molecular Formula: C4H9ClN2Molecular Weight: 120.580660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: JEBHLIYFPKISBI-UHFFFAOYSA-N

• 6-Mercapto-4(1H)-pyrimidinone
IUPAC Name: 4-sulfanyl-1H-pyrimidin-6-one | CAS Registry Number: 6311-83-7
Synonyms: NSC43264, CID238739

Molecular Formula: C4H4N2OSMolecular Weight: 128.152360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: QXFVCKOCNCYDQD-UHFFFAOYSA-N

• 3,5-Dimethoxyphenylacetonitrile
IUPAC Name: 2-(3,5-dimethoxyphenyl)acetonitrile | CAS Registry Number: 13388-75-5
Synonyms: (3,5-Dimethoxyphenyl)acetonitrile, 3,4-Dimethoxyphenylacetonitrile, 591149_ALDRICH, NSC245126, CID139445, SBB005899, ZINC00400318, TL8000012, AA-504/07219022, 93-17-4

Molecular Formula: C10H11NO2Molecular Weight: 177.199840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UUNRWZQWCNTSCV-UHFFFAOYSA-N

• 5-Androsten-3-beta-ol-7,17-dione acetate
IUPAC Name: (10,13-dimethyl-7,17-dioxo-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-yl) acetate | CAS Registry Number: 1449-61-2
Synonyms: NSC134911, 7,17-Dioxoandrost-5-en-3-yl acetate, Androst-5-en-3-ol-7,17-dione acetate

Molecular Formula: C21H28O4Molecular Weight: 344.444620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: VVSMJVQHDZUPIL-UHFFFAOYSA-N

• 2-1H-PYRIDINONE,5,6-DIHYDRO-4-(2-METHYL-2-PHENYLHYDRAZINYL)-
IUPAC Name: 4-(2-methyl-2-phenylhydrazinyl)-2,3-dihydro-1H-pyridin-6-one | CAS Registry Number: 139122-76-2
Synonyms: 4-(2-Methyl-2-phenylhydrazinyl)-5,6-dihydropyridin-2(1H)-one, SureCN8562544, PYR027, CTK8C4450, MolPort-005-938-612, ANW-71992, SBB068329, ZINC21992981, AKOS015912398, AK-58986, KB-237650, I14-6136, I14-35655, 2(1H)-Pyridinone, 5,6-dihydro-4-(2-methyl-2-phenylhydrazino)-, 5,6-Dihydro-4-(2-methyl-2-phenylhydrazino)-2(1-H)-pyridinone, 2(1H)-Pyridinone, 5,6-dihydro-4-(2-methyl-2-phenylhydrazino) pound-

Molecular Formula: C12H15N3OMolecular Weight: 217.267000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AHRRHWGQOOPSSZ-UHFFFAOYSA-N

• 1,4-Dithia-7-azaspiro[4,4]nonane-8-carboxylic acid hydrobromide
IUPAC Name: 1,4-dithia-7-azaspiro[4.4]nonane-8-carboxylic acid;hydrobromide | CAS Registry Number: 75776-79-3
Synonyms: AG-H-02101, MolPort-020-001-036, SBB067166, AKOS015904443, I111, A838506, I14-1714, 1,4-Dithia-7-azaspiro[4,4]nonane-8-carboxylic acid HBr, 6,9-dithia-3-azaspiro[4.4]nonane-2-carboxylic acid hydrobromide

Molecular Formula: C7H12BrNO2S2Molecular Weight: 286.209680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: DXALUCGGSBGKIY-UHFFFAOYSA-N

• 1(2H)-NAPHTHALENONE,4-(3,4-DICHLOROPHENYL)-3,4-DIHYDRO-,OXIME,(?)
IUPAC Name: (NE)-N-[4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine | CAS Registry Number: 124345-14-8
Synonyms: AC1O3J5P, 4-(3,4-dichlorophenyl)-3,4-dihydro-1(2H)-naphthalenone oxime, NAP002, MolPort-002-870-058, AKOS005093435, 4W-0253, 4-(3',4'-Dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-one Oxime, (NE)-N-[4-(3,4-dichlorophenyl)-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine, 1(2H)-Naphthalenone, 4-(3,4-dichlorophenyl)-3,4-dihydro-, oxime, ( inverted exclamation markA-)

Molecular Formula: C16H13Cl2NOMolecular Weight: 306.186520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CGIUOCJZIYTDRG-KNTRCKAVSA-N

• 4-Nitrophthalamide
IUPAC Name: 4-nitrobenzene-1,2-dicarboxamide | CAS Registry Number: 13138-53-9
Synonyms: 4-Nitrophthaldiamide, Maybridge1_003271, NCIOpen2_006090, 330426_ALDRICH, 1,2-Benzenedicarboxamide, 4-nitro-, NSC94821, EINECS 236-070-6, NSC 94821, ZINC00056712, ST5319938, SR-01000643795-1

Molecular Formula: C8H7N3O4Molecular Weight: 209.158880 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: XWCDSCYRIROFIO-UHFFFAOYSA-N

• 4-Hydroxyquinoline
IUPAC Name: 1H-quinolin-4-one | CAS Registry Number: 611-36-9
Synonyms: 4-Quinolinol, Quinolin-4-ol, Kynurine, 4-Chinolinol, Quinoline, 4-hydroxy-, Fragment 18, quinolin-4(1H)-one, 4(1H)-Quinolinone, CCRIS 4329, Oprea1_521432, 4-Quinolinol (8CI,9CI), H58005_ALDRICH, NSC 3183, CHEBI:15815, EINECS 210-268-2, NSC3183, AIDS020542, KUC100207N, AIDS-020542, BRN 1524969

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: PMZDQRJGMBOQBF-UHFFFAOYSA-N


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