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• BENZONITRILE,4-HYDROXY-2,3-DIMETHYL-
IUPAC Name: 4-hydroxy-2,3-dimethylbenzonitrile | CAS Registry Number: 448961-58-8
Synonyms: 4-Hydroxy-2,3-dimethylbenzonitrile, AGN-PC-025QLD, SureCN7056620, CTK8I7709, RW2691, AK141932

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LUOBVTFFWKJVTN-UHFFFAOYSA-N

• Benzoylacetonitrile
IUPAC Name: 3-oxo-3-phenylpropanenitrile | CAS Registry Number: 614-16-4
Synonyms: Phenacyl cyanide, Cyanoacetophenone, 2-Cyanoacetophenone, Acetonitrile, benzoyl-, 2-Cyanoacetyl phenone, Cyanomethyl phenyl ketone, Acetophenone, 2-cyano-, 3-Oxo-3-phenylpropanenitrile, alpha-Cyanoacetophenone, omega-Cyanoacetophenone, beta-Oxohydrocinnamonitrile, 3-Phenyl-3-ketopropionitrile, Enamine_005459, .alpha.-Cyanoacetophenone, .omega.-Cyanoacetophenone, beta-oxobenzenepropanenitrile, Benzenepropanenitrile, .beta.-oxo-, Hydrocinnamonitrile, beta-oxo-, 272728_ALDRICH, Acetonitrile, benzoyl- (8CI)

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ZJRCIQAMTAINCB-UHFFFAOYSA-N

• Cyclobutylhydrazine
IUPAC Name: cyclobutylhydrazine | CAS Registry Number: 742673-64-9
Synonyms: CYCLOBUTYLHYDRAZINE, AG-G-95135, CYCLOBUTYL-HYDRAZINE, SureCN271691, CTK5D9641, Phosphine,[(4-nitrophenyl)methyl]-, RW2684, AKOS005264444, KB-49174, BB 0260692, S14-0096

Molecular Formula: C4H10N2Molecular Weight: 86.135600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HQFQTTNMBUPQAY-UHFFFAOYSA-N

• Cyclopropane Methyl Amine
IUPAC Name: cyclopropylmethanamine | CAS Registry Number: 2516-47-4
Synonyms: Cyclopropanemethylamine, (Aminomethyl)cyclopropane, Cyclopropanemethanamine, 1-cyclopropylmethanamine, 359521_ALDRICH, 08460_FLUKA, ALBB-005351, EINECS 219-737-6, STK328116, InChI=1/C4H9N/c5-3-4-1-2-4/h4H,1-3,5H

Molecular Formula: C4H9NMolecular Weight: 71.120960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: IGSKHXTUVXSOMB-UHFFFAOYSA-N

• Ethyl 1-Methyl-1H-Imidazole-2-Carboxylate
IUPAC Name: ethyl 1-methylimidazole-2-carboxylate | CAS Registry Number: 30148-21-1
Synonyms: Ethyl 1-Methylimidazole-2-carboxylate, ethyl 1-methyl-1h-imidazole-2-carboxylate, ETHYL1-METHYLIMIDAZOLE-2-CARBOXYLATE, SBB013235, AG-E-98817, ZERO/005211, PubChem22681, AC1N6LG3, SureCN1822302, CTK4G4558, MolPort-001-768-759, ACN-P000764, ACN-S004115, ACT07790, ANW-50540, RW2657, STK735183, ZINC03880843, AKOS003396279, AC-7073

Molecular Formula: C7H10N2O2Molecular Weight: 154.166500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NOTZYDYZBOBDFE-UHFFFAOYSA-N

• Ethyl 4-Oxocyclohexaneacetate
IUPAC Name: ethyl 2-(4-oxocyclohexyl)acetate | CAS Registry Number: 58012-34-3
Synonyms: Ethyl 2-(4-oxocyclohexyl)acetate, SureCN2257497, ethyl 4-oxocyclohexaneacetate, RW2721, AKOS006307852, AK114276, KB-51305, M112047

Molecular Formula: C10H16O3Molecular Weight: 184.232240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XHNJFNLTFMAPQB-UHFFFAOYSA-N

• methyl 3-(2-fluoro-4-methoxyphenyl)propanoate
IUPAC Name: methyl 3-(2-fluoro-4-methoxyphenyl)propanoate | CAS Registry Number: 874187-38-9
Synonyms: SureCN1924061, RW2701, AK141938, Methyl 3-(2-fluoro-4-methoxyphenyl)propanoate

Molecular Formula: C11H13FO3Molecular Weight: 212.217523 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HKQQUWYOQCIJQD-UHFFFAOYSA-N

• methyl 3-(piperidin-4-yl)propanoate hydrochloride
IUPAC Name: methyl 3-piperidin-4-ylpropanoate;hydrochloride | CAS Registry Number: 167414-87-1
Synonyms: Methyl 3-(piperidin-4-yl)propanoate hydrochloride, METHYL3-(4-PIPERIDINYL)PROPANOATE HYDROCHLORIDE, SureCN382045, CTK0A8690, RW2631, AK141917, 4-Piperidinepropanoic acid, methyl ester, hydrochloride

Molecular Formula: C9H18ClNO2Molecular Weight: 207.697720 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AZXUUZJIMVNVCN-UHFFFAOYSA-N

• METHYL 6-CHLOROPYRIMIDINE-4-CARBOXYLATE
IUPAC Name: methyl 6-chloropyrimidine-4-carboxylate | CAS Registry Number: 6627-22-1
Synonyms: NSC58346, CID245927

Molecular Formula: C6H5ClN2O2Molecular Weight: 172.569100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: IAEUEOUJKNGPMO-UHFFFAOYSA-N

• N,N-dimethyl-4-(3-piperidinylmethyl)-2-Pyrimidinamine
IUPAC Name: N,N-dimethyl-4-(piperidin-3-ylmethyl)pyrimidin-2-amine | CAS Registry Number: 1359705-77-3
Synonyms: RW2649, AK141922, N,N-Dimethyl-4-(piperidin-3-ylmethyl)pyrimidin-2-amine

Molecular Formula: C12H20N4Molecular Weight: 220.314000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OQDTXZAMLUTVLL-UHFFFAOYSA-N

• N-Ethyl-Benzenemethanamine
IUPAC Name: N-benzylethanamine | CAS Registry Number: 14321-27-8
Synonyms: N-Ethylbenzylamine, Benzylamine der, N-benzylethanamine, N-Benzylethylamine, Benzenemethanamine, N-ethyl-, Benzylamine, N-ethyl-, N-Benzyl-N-ethylamine, N-(phenylmethyl)ethanamine, BENZYL-ETHYL-AMINE, 126993_ALDRICH, EINECS 238-265-1, NSC7413, AIDS011070, AIDS-011070, CID84352, BBR-007304, 5417-36-7 (HYDROCHLORIDE), LS-184962, I01-1150, InChI=1/C9H13N/c1-2-10-8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H

Molecular Formula: C9H13NMolecular Weight: 135.206220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: HVAAHUDGWQAAOJ-UHFFFAOYSA-N

• N-EthylGlycine
IUPAC Name: 2-(ethylazaniumyl)acetate | CAS Registry Number: 627-01-0
Synonyms: N-Ethylglycine, ZINC01532340, CPD-10490, CID6992079

Molecular Formula: C4H9NO2Molecular Weight: 103.119760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YPIGGYHFMKJNKV-UHFFFAOYSA-N

• Tetrahydro-3-(4-Piperidinyl)-2H-1,3-Oxazin-2-One
IUPAC Name: 3-piperidin-4-yl-1,3-oxazinan-2-one | CAS Registry Number: 164518-99-4
Synonyms: 3-(Piperidin-4-yl)-1,3-oxazinan-2-one, SureCN2855915, CTK8C1038, MolPort-012-800-846, ANW-65767, RW2624, AKOS010604995, QC-7748, AK-88996, KB-69971

Molecular Formula: C9H16N2O2Molecular Weight: 184.235540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: UAMPFCXIVPCTCN-UHFFFAOYSA-N

• 3-(4-Piperidinyl)-2-Oxazolidinone
IUPAC Name: 3-piperidin-4-yl-1,3-oxazolidin-2-one | CAS Registry Number: 164518-96-1
Synonyms: 3-(PIPERIDIN-4-YL)OXAZOLIDIN-2-ONE, 3-(4-piperidinyl)-2-Oxazolidinone, AGN-PC-00KORI, SureCN1662903, CTK4D1835, MolPort-012-800-357, ANW-65768, RW2623, AKOS010604324, 2-Oxazolidinone, 3-(4-piperidinyl)-, AG-I-03134, QC-7747, AK-88995, KB-69877

Molecular Formula: C8H14N2O2Molecular Weight: 170.208960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SQGSXVBOGZMGFV-UHFFFAOYSA-N

• 4-[2-(2-Methyl-1H-Imidazol-1-Yl)ethyl]Piperidine
IUPAC Name: 4-[2-(2-methylimidazol-1-yl)ethyl]piperidine | CAS Registry Number: 130516-99-3
Synonyms: 4-[2-(2-Methyl-imidazol-1-yl)-ethyl]-piperidine, AG-D-61981, ST073984, 4-(2-(2-Methyl-1H-imidazol-1-yl)ethyl)piperidine, 2-methyl-1-(2-(4-piperidyl)ethyl)imidazole, 4-[2-(2-methyl-1H-imidazol-1-yl)ethyl]piperidine, BAS 12820963, AC1O5IFH, AC1Q2P4F, SureCN2237220, CTK4B6780, MolPort-002-023-886, HMS1699I08, ANW-58913, RW2625, SBB010901, AKOS000302210, AK-57396, KB-71934, 4-[2-(2-methylimidazol-1-yl)ethyl]piperidine

Molecular Formula: C11H19N3Molecular Weight: 193.288660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: FPCPADMQGUJDCY-UHFFFAOYSA-N

• 4-EthylBenzenepropanoic Acid
IUPAC Name: 3-(4-ethylphenyl)propanoate | CAS Registry Number: 64740-36-9
Synonyms: ZINC02580667, CID2064038

Molecular Formula: C11H13O2-Molecular Weight: 177.219720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MUQCDEGKKWQCAO-UHFFFAOYSA-M

• 5-(chlorosulfonyl)-2-FluoroBenzoic Acid
IUPAC Name: 5-chlorosulfonyl-2-fluorobenzoic acid | CAS Registry Number: 37098-75-2
Synonyms: 5-(chlorosulfonyl)-2-fluorobenzoic acid, 2-Fluoro-5-(chlorosulfonyl)benzoic acid, 5-(Chlorosulphonyl)-2-fluorobenzoic acid, AG-F-29857, 5-Chlorosulfonyl-2-fluoro-benzoic acid, AC1LCYLV, ACMC-1AFAW, AC1Q72VA, Ambcb4031390, KSC577O0R, CTK4H7708, MolPort-002-466-796, ANW-28561, RW2695, SBB078627, 5-chlorosulfonyl-2-fluorobenzoic acid, AKOS000365631, 5-(Chlorosulfonyl)-2-fluorobenzoicacid, AB13005, AG-A-81662

Molecular Formula: C7H4ClFO4SMolecular Weight: 238.620663 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CISMZCVQNVNWJW-UHFFFAOYSA-N

• 2-Methyl-1H-Benzimidazol-6-Amine
IUPAC Name: 2-methyl-3H-benzimidazol-5-amine | CAS Registry Number: 29043-48-9
Synonyms: 2-Methyl-1H-benzimidazol-5-amine, Oprea1_595207, ZERO/005255, MolPort-000-160-333, MolPort-001-792-674, NSC240761, ALBB-005602, CID315500, STK394271, ZINC00368808, 1H-Benzimidazol-5-amine, 2-methyl-, 2-Methyl-3H-benzoimidazol-5-ylamine, GL-0784, BAS 03420893, 23291-87-4

Molecular Formula: C8H9N3Molecular Weight: 147.177160 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: UJYKXBDYOPPOCY-UHFFFAOYSA-N

• 1-(2-Aminoethyl)-2-Piperidinone
IUPAC Name: 1-(2-aminoethyl)piperidin-2-one | CAS Registry Number: 27578-61-6
Synonyms: 1-(2-Aminoethyl)piperidin-2-one, 1-(2-aminoethyl)-2-Piperidinone, AGN-PC-01XEEK, Ambcb4014128, SureCN1446472, MolPort-002-013-422, ANW-58466, QC-699, RW2620, 2-Piperidinone, 1-(2-aminoethyl)-, AKOS000558724, AK-81570, KB-63808, BB 0260042

Molecular Formula: C7H14N2OMolecular Weight: 142.198860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RSDYQUTYAZWYEK-UHFFFAOYSA-N

• 4,6-Dichloro-2-Methyl-5-Pyrimidinecarboxaldehyde
IUPAC Name: 4,6-dichloro-2-methylpyrimidine-5-carbaldehyde | CAS Registry Number: 14160-91-9
Synonyms: 4,6-DICHLORO-2-METHYLPYRIMIDINE-5-CARBALDEHYDE, AG-D-82769, 5-PYRIMIDINECARBOXALDEHYDE, 4,6-DICHLORO-2-METHYL-, 4,6-dichloro-2-methyl-5-pyrimidinecarboxaldehyde, PubChem16128, CTK4C2713, ANW-59205, RW2636, AKOS006314916, AB54916, AK-43204, KB-44095, A807782, 5-PYRIMIDINEcarbaldehyde,4,6-DICHLORO-2-methyl-, 4,6-bis(chloranyl)-2-methyl-pyrimidine-5-carbaldehyde, 4,6-DICHLORO-2-METHYLPYRIMIDINE-5-CARBOXALDEHYDE

Molecular Formula: C6H4Cl2N2OMolecular Weight: 191.014760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DOMBYPXLCGLBRD-UHFFFAOYSA-N

• 1-(phenylmethyl)- 3-Piperidineacetonitrile
IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide | CAS Registry Number: 5562-20-9
Synonyms: ZINC02653852, CID2117287, T5266816

Molecular Formula: C19H19N3O3S2Molecular Weight: 401.502460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: CPBZXAOGOISBKS-UHFFFAOYSA-N

• 5-Amino-3-phenylpyrazole
IUPAC Name: 5-phenyl-1H-pyrazol-3-amine | CAS Registry Number: 827-41-8
Synonyms: 3-Amino-5-phenylpyrazole, 3-Phenyl-1H-pyrazol-5-amine, Maybridge1_004361, Pyrazole, 5-amino-3-phenyl-, 1H-Pyrazol-3-amine, 5-phenyl-, 393797_ALDRICH, BRN 0004947, SBB005555, ZINC00154772, ZINC03887184, GL-0701, LS-128035, ST5210444, 4-25-00-02617 (Beilstein Handbook Reference), 1572-10-7

Molecular Formula: C9H9N3Molecular Weight: 159.187860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PWSZRRFDVPMZGM-UHFFFAOYSA-N

• 7-methoxy-3,4-dihydro-2h-benzo[1,4]oxazine
IUPAC Name: 7-methoxy-3,4-dihydro-2H-1,4-benzoxazine | CAS Registry Number: 93735-22-9
Synonyms: 7-METHOXY-3,4-DIHYDRO-2H-BENZO[1,4]OXAZINE, 7-Methoxy-3,4-dihydro-2H-benzo[b][1,4]oxazine, 7-METHOXY-3,4-DIHYDRO-2H-1,4-BENZOXAZINE, SureCN4233305, CTK5H2886, RW2719, AKOS006307394, AG-H-82925, MB09263, AK140716, KB-204811

Molecular Formula: C9H11NO2Molecular Weight: 165.189140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: SHPHWZPKRWHBKE-UHFFFAOYSA-N

• 3-Acetylbenzonitrile
IUPAC Name: 3-acetylbenzonitrile | CAS Registry Number: 6136-68-1
Synonyms: m-Cyanoacetophenone, 3'-Cyanoacetophenone, 292214_ALDRICH, EINECS 228-110-6, NSC210360, ZINC01745805, InChI=1/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SBCFGFDAZCTSRH-UHFFFAOYSA-N

• 2,4-Dichloro-5-methylpyrimidine
IUPAC Name: 2,4-dichloro-5-methylpyrimidine | CAS Registry Number: 1780-31-0
Synonyms: D66182_ALDRICH, 5-Methyl-2,4-dichloropyrimidine, NSC37532, Pyrimidine, 2,4-dichloro-5-methyl-, CID74508, EINECS 217-227-8, NSC 37532, InChI=1/C5H4Cl2N2/c1-3-2-8-5(7)9-4(3)6/h2H,1H

Molecular Formula: C5H4Cl2N2Molecular Weight: 163.004660 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: DQXNTSXKIUZJJS-UHFFFAOYSA-N

• 3-Aminomethyl piperidine
IUPAC Name: piperidin-3-ylmethanamine | CAS Registry Number: 23099-21-0
Synonyms: 3-Aminomethyl-piperidine, Piperidine-3-methylamine, EINECS 245-428-0, TL8001925

Molecular Formula: C6H14N2Molecular Weight: 114.188760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: IPOVLZSJBYKHHU-UHFFFAOYSA-N

• 4-Bromo Thiazole
IUPAC Name: pyrimidine-4-carbaldehyde | CAS Registry Number: 2435-50-9
Synonyms: Pyrimidine-4-carbaldehyde, PYRIMIDINE-4-CARBOXALDEHYDE, 4-Pyrimidinecarboxaldehyde, 4-Formylpyrimidine, 4-Formyl-1,3-diazine, 4-pyrimidine carbaldehyde, SBB065687, AG-E-72260, ACMC-1CP8L, AGN-PC-008LFK, CTK1A1561, MolPort-000-006-277, ANW-25409, RW2643, ZINC02511465, AKOS012052139, AB16150, AM84826, RP18886, AK-23925

Molecular Formula: C5H4N2OMolecular Weight: 108.098060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OKULHRWWYCFJAB-UHFFFAOYSA-N

• 2-Chloro-6-methylnicotinic acid
IUPAC Name: 2-chloro-6-methylpyridine-3-carboxylic acid | CAS Registry Number: 30529-70-5
Synonyms: 357847_ALDRICH, ALBB-005466, EINECS 250-229-7, SBB003843, 2-Chloro-6-methyl-3-pyridinecarboxylic acid, 3-Pyridinecarboxylic acid, 2-chloro-6-methyl-, InChI=1/C7H6ClNO2/c1-4-2-3-5(7(10)11)6(8)9-4/h2-3H,1H3,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ACQXHCHKMFYDPM-UHFFFAOYSA-N

• 2-Hydroxy-6-methylnicotinic acid
IUPAC Name: 6-methyl-2-oxo-1H-pyridine-3-carboxylic acid | CAS Registry Number: 38116-61-9
Synonyms: Maybridge3_006033, Oprea1_731245, H43008_ALDRICH, 6-Methyl-3-carboxy-2-pyridone, 2-Hydroxy-6-methylpyridine-3-carboxylic acid, NSC10728, EINECS 253-784-3, SBB004049, IDI1_017420, SB 01990, 6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid, 3-Pyridinecarboxylic acid, 1,2-dihydro-6-methyl-2-oxo-, InChI=1/C7H7NO3/c1-4-2-3-5(7(10)11)6(9)8-4/h2-3H,1H3,(H,8,9)(H,10,11

Molecular Formula: C7H7NO3Molecular Weight: 153.135380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XRIHTJYXIHOBDQ-UHFFFAOYSA-N

• 4-Piperidine acetic acid Hydrochloride
IUPAC Name: 2-piperidin-4-ylacetic acid | CAS Registry Number: 51052-78-9
Synonyms: piperidin-4-ylacetic acid, 2-(piperidin-4-yl)acetic acid, Piperidine-4-ylacetic acid, 4-piperidine acetic acid, 4-PiperidineaceticacidHCl, 73415-84-6, AN-584/43294048, piperidin-4-ylacetic acid hydrochloride, 4-piperidinylacetic acid, AC1LTQG2, Piperidine-4-acetic acid, SureCN44579, Piperidine-4-yl-acetic acid, 2-piperidin-4-ylacetic acid, AC1Q753J, MolPort-001-770-213, ALBB-008873, ANW-48784, RW2628, STK505633

Molecular Formula: C7H13NO2Molecular Weight: 143.183620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: YFNOTMRKVGZZNF-UHFFFAOYSA-N

• 4-hydrazinyl-1-methylpiperidine
IUPAC Name: (1-methylpiperidin-4-yl)hydrazine | CAS Registry Number: 51304-64-4
Synonyms: 4-HYDRAZINYL-1-METHYLPIPERIDINE, 1-(1-methylpiperidin-4-yl)hydrazine, AG-F-73476, SureCN1117982, 4-Hydrazino-1-methylpiperidine, CTK4J4011, MolPort-003-991-354, ANW-60609, RW2685, WTI-11529, AKOS000152283, AG-A-75560, QC-8918, AK-88932, BP-11912, KB-38986, AB1008907, BB 0219977, FT-0677439, I14-30119

Molecular Formula: C6H15N3Molecular Weight: 129.203400 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GSUCKVZTSXHESM-UHFFFAOYSA-N

• 6-Hydroxy-4-Pyrimidinecarboxylic Acid
IUPAC Name: 4-oxo-1H-pyrimidine-6-carboxylic acid | CAS Registry Number: 6299-87-2
Synonyms: Pyrimidin-6-ol-4-carboxylic acid, NSC45047, CID239692, 6-Hydroxy-4-pyrimidinecarboxylic acid

Molecular Formula: C5H4N2O3Molecular Weight: 140.096860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QYGHXDAYBIFGKI-UHFFFAOYSA-N

• 3-Amino-3-(3-pyridyl)propionic acid
IUPAC Name: 3-amino-3-pyridin-3-ylpropanoic acid | CAS Registry Number: 62247-21-6
Synonyms: 3-amino-3-(pyridin-3-yl)propanoic acid, (RS)-3-Amino-3-(3-Pyridyl)-Propionic Acid, 3-amino-3-pyridin-3-ylpropanoic acid, 3-Amino-3-(3'-pyridyl)propionic acid, 3-Amino-3-pyridin-3-yl-propionic acid, 3-Amino-3-(3-pyridyl)propionicacid, AG-G-28416, 3-amino-3-(3-pyridinyl)propanoic acid, DL-3-Amino-3-(3'-pyridyl)-propionic acid, 3-azanyl-3-pyridin-3-yl-propanoic acid, 3-Pyridinepropanoicacid, b-amino-, (bS)-, ACMC-20dpuq, PubChem13900, ACMC-1C5QQ, SureCN157097, AC1MTR69, Oprea1_753917, KSC497A1R, RARECHEM AK HC S246, STOCK1N-13575

Molecular Formula: C8H10N2O2Molecular Weight: 166.177200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QOTCEJINJFHMLO-UHFFFAOYSA-N

• 5-Amino-1-phenyl-1H-pyrazole-4-carboxylic acid
IUPAC Name: 5-amino-1-phenylpyrazole-4-carboxylic acid | CAS Registry Number: 51649-80-0
Synonyms: 5-amino-1-phenylpyrazole-4-carboxylic acid, AG-F-75074, BAS 00327297, AC1Q5UUV, ChemDiv2_003205, AC1LF4N4, SureCN1335080, CBDivE_004912, MLS000716674, 639818_ALDRICH, AC1Q50X8, CTK4J4621, MolPort-000-870-356, BB_SC-7780, HMS1378B15, HMS2656C07, 1-Phenyl-4-carboxy-5-aminopyrazole, AR-1G7034, BBL012325, RW2651

Molecular Formula: C10H9N3O2Molecular Weight: 203.197360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BFMGSMOYBHOHGI-UHFFFAOYSA-N

• 6-Chloro-3-nitropyridine-2-carbonitrile
IUPAC Name: 6-chloro-3-nitropyridine-2-carbonitrile | CAS Registry Number: 93683-65-9
Synonyms: 6-Chloro-2-cyano-3-nitropyridine, 6-chloro-3-nitropicolinonitrile, 6-Chloro-3-nitro-2-pyridinecarbonitrile, 6-Chloro-2-cyano-3-nitropyidine, SBB054357, AG-H-82756, PubChem2248, PubChem19121, AGN-PC-00M7WR, CTK5H2796, MolPort-001-769-561, WT551, ANW-57916, CK1207, RW2705, ZINC14982436, AKOS006344485, LS20723, PB21909, RP24427

Molecular Formula: C6H2ClN3O2Molecular Weight: 183.551980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: XVIHGTRTKQZJAC-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

• 2,2-Diethoxyethanethioamide
IUPAC Name: 2,2-diethoxyethanethioamide | CAS Registry Number: 73956-15-7
Synonyms: 2,2-diethoxyethanethioamide, SBB056474, AG-G-93324, ZINC04287560, AC1MDRRW, 2,2-Diethoxythioacetamide, Ethanethioamide,2,2-diethoxy-, CTK5D8999, MolPort-000-145-153, ACT03871, RW2672, 1-amino-2,2-diethoxyethane-1-thione, AKOS006237671, BP-20426, KB-67113, A9513, FT-0660034, I09-1350

Molecular Formula: C6H13NO2SMolecular Weight: 163.237920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MQSDGAKLSVITHP-UHFFFAOYSA-N

• 3-(4-Piperidyl)propionic Acid
IUPAC Name: 3-piperidin-4-ylpropanoic acid | CAS Registry Number: 1822-32-8
Synonyms: 3-Piperidin-4-yl-propionic acid, 3-piperidin-4-ylpropanoic acid, 3-(Piperidin-4-yl)propanoicacid, 3-(piperidin-4-yl)propanoic acid, SBB066836, 3-(4-piperidyl)propanoic Acid, PubChem19136, 4-Piperidinepropanoicacid, 4-Piperidinepropanoic acid, SureCN954535, AC1Q75BP, AC1LU518, CHEMBL110858, CTK0H4189, 3-Piperidin-4-yl-propanoic acid, 3-Piperidine-4-yl-propionic acid, CHEBI:283107, MolPort-000-006-000, ANW-75292, RW2627

Molecular Formula: C8H15NO2Molecular Weight: 157.210200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: AUYQMCCWFNSFGV-UHFFFAOYSA-N

• 2-Piperazin-Yl-4-(trifluoromethyl)pyrimidine
IUPAC Name: 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine | CAS Registry Number: 179756-91-3
Synonyms: 2-Piperazin-yl-4-(trifluoromethyl)pyrimidine, 2-(piperazin-1-yl)-4-(trifluoromethyl)pyrimidine, 1-[4-(Trifluoromethyl)pyrimid-2-yl]piperazine, 1-(4-Trifluoromethylpyrimidin-2-yl)piperazine, 2-piperazin-1-yl-4-(trifluoromethyl)pyrimidine, SBB022824, AG-E-30035, 1-(4-trifluoromethyl-pyrimidin-2-yl)piperazine, 4-(Trifluoromethyl)-2-(piperazin-1-yl)pyrimidine, 2-piperazinyl-4-(trifluoromethyl)pyrimidine, AC1Q4JFX, SureCN230177, AC1MCT28, KSC537G7N, CHEMBL2335157, CTK4D7376, MolPort-000-006-568, ACT03744, ANW-56587, RW2634

Molecular Formula: C9H11F3N4Molecular Weight: 232.205650 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: WBJVPAABGFBMJQ-UHFFFAOYSA-N

• 4-(aminoethyl)piperidine
IUPAC Name: 2-piperidin-4-ylethanamine | CAS Registry Number: 76025-62-2
Synonyms: 2-(Piperidin-4-yl)ethanamine, 2-(piperidin-4-yl)ethan-1-amine, 4-Piperidineethanamine, AC1LTQGH, SureCN331464, 2-piperidin-4-ylethanamine, AC1Q54DD, 4-AMINOETHYLPIPERIDINE, MolPort-002-344-059, 4-(2-AMINOETHYL)PIPERIDINE, ANW-75211, RW2629, AKOS010394508, AG-C-31282, MCULE-9932609620, AK-82213, AM101244, KB-40324, KB-142484, FT-0689825

Molecular Formula: C7H16N2Molecular Weight: 128.215340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PXJBCMWIAPDWAU-UHFFFAOYSA-N

• 3-Pyridinecarboxylic Acid, 2-Chloro-5,6-Dimethyl-
IUPAC Name: 2-chloro-5,6-dimethylpyridine-3-carboxylic acid | CAS Registry Number: 120003-75-0
Synonyms: 2-chloro-5,6-dimethylpyridine-3-carboxylic acid, 2-Chloro-5,6-dimethylnicotinic acid, 2-Chloro-5,6-dimethyl-nicotinic acid, SBB010728, 3-Pyridinecarboxylic acid, 2-chloro-5,6-dimethyl-, ACMC-20afxk, BAS 10144300, AC1O5H5D, CTK0C4035, MolPort-002-017-479, HMS1703G03, ANW-71574, RW2710, 2-chloro-5,6-dimethyl nicotinic acid, AKOS000303181, AG-A-39962, QC-8937, RP03403, AK-77780, KB-229805

Molecular Formula: C8H8ClNO2Molecular Weight: 185.607620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JGTHNXDWSRAIAT-UHFFFAOYSA-N

• (5-Amino-1h-Benzimidazol-2-Yl)methanol
IUPAC Name: (6-amino-1H-benzimidazol-2-yl)methanol | CAS Registry Number: 294656-36-3
Synonyms: (5-Amino-1H-benzoimidazol-2-yl)-methanol, (5-Aminobenzimidazol-2-yl)methanol, (5-amino-1H-benzimidazol-2-yl)methanol, (5-Amino-1H-benzo[d]imidazol-2-yl)methanol, 3411-71-0, AC1LHIMQ, SureCN520978, SureCN3947749, Oprea1_307912, Oprea1_491938, STOCK6S-44410, CTK4H1759, CTK8D3943, MolPort-000-000-990, HMS1686G17, ANW-62725, BBL012603, RW2655, STK394272, ZINC06493922

Molecular Formula: C8H9N3OMolecular Weight: 163.176560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: AVKZEQGMZMYWRR-UHFFFAOYSA-N

• 5-Fluoro-2-Methylbenzimidazole
IUPAC Name: 6-fluoro-2-methyl-1H-benzimidazole | CAS Registry Number: 118469-15-1
Synonyms: 5-FLUORO-2-METHYLBENZIMIDAZOLE, 6-fluoro-2-methyl-1H-benzimidazole, 5-fluoro-2-methyl-1H-benzo[d]imidazole, 1H-Benzimidazole,6-fluoro-2-methyl-, AG-D-40822, 5-fluoro-2-methyl-1H-1,3-benzodiazole, 5-FLUORO-2-METHYLBENZO[D]IMIDAZOLE, ACMC-20mntv, PubChem6528, AC1MCQ6Q, SureCN2008567, SureCN7590755, CTK4B0692, MolPort-001-778-330, 5-fluoro-2-methyl-1H-benzimidazole, ANW-58094, PC9456, RW2656, SBB086701, ZINC12672023

Molecular Formula: C8H7FN2Molecular Weight: 150.152983 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IWDUKSHNFODGKM-UHFFFAOYSA-N

• 2-(4-Phenyl-1,3-Thiazol-2-Yl)Acetonitrile
IUPAC Name: 2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile | CAS Registry Number: 41381-89-9
Synonyms: Maybridge1_006883, CID704539, ZINC00088487, BAS 01020743, (4-Phenyl-thiazol-2-yl)-acetonitrile, BBV-097176, SR-01000632051-1

Molecular Formula: C11H8N2SMolecular Weight: 200.259620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: SOFCSIBVJROWGI-UHFFFAOYSA-N

• 2-[2-(4-Piperidinyl)ethyl]pyridine
IUPAC Name: 2-(2-piperidin-4-ylethyl)pyridine | CAS Registry Number: 1001754-72-8
Synonyms: 2-(2-(Piperidin-4-yl)ethyl)pyridine, AC1Q28Q8, MolPort-019-878-605, ANW-65770, RW2626, 2-[2-(4-piperidinyl)ethyl]pyridine, 2-(2-Piperidin-4-Yl-Ethyl)Pyridine, AKOS006304988, 2-[2-(4-piperidinyl)ethyl]-Pyridine, QC-8931, AK-88993, KB-67937

Molecular Formula: C12H18N2Molecular Weight: 190.284720 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DWUJDNHHQKEOPR-UHFFFAOYSA-N

• 4-Amino-3,4-Dihydro-2(1H)-Quinolinone
IUPAC Name: 4-amino-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 858783-30-9
Synonyms: 4-amino-3,4-dihydro-2(1H)-quinolinone, 4-Amino-3,4-dihydroquinolin-2(1H)-one, Ambcb4013764, SureCN12050556, CTK5F5879, MolPort-016-631-005, ANW-65760, RW2681, AKOS006282123, AG-I-03319, AK-89003, KB-72017

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

InChIKey: DLABPBKCFXRHPA-UHFFFAOYSA-N

• 4-Chloro-5-Methyl-2-(methylsulfonyl)Pyrimidine
IUPAC Name: 4-chloro-5-methyl-2-methylsulfonylpyrimidine | CAS Registry Number: 325780-94-7
Synonyms: 4-Chloro-5-methyl-2-(methylsulfonyl)pyrimidine, 4-chloro-5-methyl-2-(methylsulfonyl)-Pyrimidine, AGN-PC-005SZH, CTK8B5000, MolPort-019-878-604, ANW-46981, RW2635, AKOS015998714, HP23668, AK-80580, KB-72322, W5435, Pyrimidine, 4-chloro-5-methyl-2-(methylsulfonyl)-

Molecular Formula: C6H7ClN2O2SMolecular Weight: 206.649980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WIBJFLAPPUYODA-UHFFFAOYSA-N

• 4-[(2-Fluorophenyl)methyl]Piperidine
IUPAC Name: 4-[(2-fluorophenyl)methyl]piperidine | CAS Registry Number: 194288-97-6
Synonyms: 4-(2-fluorobenzyl)piperidine, 4-[(2-fluorophenyl)methyl]piperidine, SureCN3965587, CTK8C1035, MolPort-002-053-744, ANW-65764, RW2619, AKOS011791284, MCULE-2342972687, QC-7745, 4-[(2-fluorophenyl)-methyl]-piperidine, AK-88999, KB-71456, AM20030261, EN300-73658, I14-23453

Molecular Formula: C12H16FNMolecular Weight: 193.260543 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: HPTZGYXMDTTYBG-UHFFFAOYSA-N

• 6-Chloro-Pyrido[3,2-D]pyrimidin-4(3H)-One
IUPAC Name: 6-chloro-1H-pyrido[3,2-d]pyrimidin-4-one | CAS Registry Number: 171178-33-9
Synonyms: 6-Chloropyrido[3,2-d]pyrimidin-4(3H)-one, AG-E-20511, 6-Chloro-pyrido[3,2-d]pyrimidin-4(3H)-one, PYRIDO[3,2-D]PYRIMIDIN-4(3H)-ONE, 6-CHLORO-, ACMC-209e2l, CTK4D3838, YAALXPGJSHTRFX-UHFFFAOYSA-, ANW-22507, RW2633, SC2491, AKOS006346566, RP08959, AK-43516, AM803324, BR-43516, KB-73935, FT-0660696, W3732, InChI=1/C7H4ClN3O/c8-5-2-1-4-6(11-5)7(12)10-3-9-4/h1-3H,(H,9,10,12)

Molecular Formula: C7H4ClN3OMolecular Weight: 181.579160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YAALXPGJSHTRFX-UHFFFAOYSA-N

• 4-Piperidinepropanamine
IUPAC Name: 3-piperidin-4-ylpropan-1-amine | CAS Registry Number: 860229-31-8
Synonyms: 3-(Piperidin-4-yl)propan-1-amine, AGN-PC-00EESQ, SureCN4079555, MolPort-012-672-103, ANW-65758, RW2630, AKOS005216590, AK-89006, AM101377, KB-72885, KB-142496

Molecular Formula: C8H18N2Molecular Weight: 142.241920 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CVMKBMWKWYXTRH-UHFFFAOYSA-N


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