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Shanghai Yishi Chemical Technology Co., Ltd.

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Profile: Shanghai Yishi Chemical Technology Co., Ltd. is a manufacturer of products including glyoxal, 3-bromo-cyclohexene, 1,1,3-trichloroprop-1-ene, 2-thiocyanatopropane, 1-(2-nitrophenylmethyl)-2-pyrrolecarboxaldehydye, and bicyclo[3.3.1]nonane-2,6-dione.

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• Abiraterone
IUPAC Name: (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-pyridin-3-yl-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol | CAS Registry Number: 154229-19-3
Synonyms: UNII-G819A456D0, CHEBI:522175, CID132971, ZINC03797541, CB 7598, CB-7598, 17-(3-Pyridyl)androsta-5,16-dien-3beta-ol, Androsta-5,16-dien-3-ol, 17-(3-pyridinyl)-, (3beta)-, (3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

Molecular Formula: C24H31NOMolecular Weight: 349.509040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GZOSMCIZMLWJML-VJLLXTKPSA-N

• ABT-869 (Linifanib)
IUPAC Name: 1-[4-(3-amino-1H-indazol-4-yl)phenyl]-3-(2-fluoro-5-methylphenyl)urea | CAS Registry Number: 796967-16-3
Synonyms: ABT-869, ABT 869, CHEBI:471147, CID11485656, EC-000.2119, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)urea, 1-(4-(3-amino-1H-indazol-4-yl)phenyl)-3-(2-fluoro-5-methylphenyl)urea, N-(4-(3-Amino-1H-indazol-4-yl)phenyl)-N1-(2-fluoro-5-methylphenyl)urea, N-[4-(3-amino-1H-indazol-4-yl)phenyl]-N'-(2-fluoro-5-methylphenyl)urea, Urea, N-(4-(3-amino-1H-indazol-4-yl)phenyl)-N'-(2-fluoro-5-methylphenyl)-

Molecular Formula: C21H18FN5OMolecular Weight: 375.398923 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 4

InChIKey: MPVGZUGXCQEXTM-UHFFFAOYSA-N

• ACETIC ACID (1-METHYLHYDRAZINYL)-,TERT-BUTYL ESTER
IUPAC Name: tert-butyl 2-[amino(methyl)amino]acetate | CAS Registry Number: 144036-71-5
Synonyms: tert-Butyl 2-(1-methylhydrazinyl)acetate, AGN-PC-00GIUH, CTK8B4722, MolPort-004-763-714, ANW-45954, QC-499, RB3105, AKOS015998737, AM62679, AK-86688, FT-0687865, W3141, Acetic acid, (1-methylhydrazino)-, 1,1-dimethylethyl ester, Acetic acid, 2-(1-methylhydrazinyl)-, 1,1-dimethylethyl ester, ACETIC ACID,2-(1-METHYLHYDRAZINYL)-, 1,1-DIMETHYLETHYL ESTER

Molecular Formula: C7H16N2O2Molecular Weight: 160.214140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GNAZZEYMVIVFQM-UHFFFAOYSA-N

• ALFA-BROMOISOVALERIC ACID
IUPAC Name: 2-bromo-4-methylpentanoic acid | CAS Registry Number: 49628-52-6
Synonyms: Valeric acid, 2-bromo-4-methyl-,, 2-bromo-4-methylpentanoic acid, MolPort-001-780-224, CID142681, S04-0143

Molecular Formula: C6H11BrO2Molecular Weight: 195.054340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: NNFDHJQLIFECSR-UHFFFAOYSA-N

• Androst-5-en-17-one
IUPAC Name: 10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one | CAS Registry Number: 25824-80-0
Synonyms: 10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one, AC1LDOZV, CTK8H8682, CHEBI:210886, A818041, Androst-5-en-17-one(3-Deoxydehydroepiandrosterone), I06-0458

Molecular Formula: C19H28OMolecular Weight: 272.425020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AFGDPPHTYUQKOF-UHFFFAOYSA-N

• Benzyl Octahydrocyclopenta[B]Pyrrole-2-Carboxylate Hydrochloride
IUPAC Name: benzyl 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate;hydrochloride | CAS Registry Number: 1042674-26-9
Synonyms: Benzyl 2-azabicyclo[3.3.0]octane-3-carboxylate hydrochloride, benzyl octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride, 93779-29-4, (S,S)-2-Azabicyclo[3,3,0]-octane-3-carboxylic acid benzylester hydrochloride, (phenylmethyl) 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride, 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[b]pyrrole-2-carboxylic acid (phenylmethyl) ester hydrochloride, AGN-PC-00LINI, SureCN5473651, 652547_ALDRICH, CTK4A2900, AKOS015849574, AG-L-20190, AC-13653, KB-200556, FT-0657090, M-1376, A800945, A844706, S14-0833, benzyl-octahydrocyclopenta[b]pyrrole-2-carboxylate hydrochloride

Molecular Formula: C15H20ClNO2Molecular Weight: 281.777800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: HLXCXOQXUDRJLF-UHFFFAOYSA-N

• Benzylhydrazine dihydrochloride
IUPAC Name: benzylhydrazine dihydrochloride | CAS Registry Number: 20570-96-1
Synonyms: Benzylhydrazine.2HCl, BENZYL HYDRAZINE di HCl, Hydrazine, benzyl-, dihydrochloride, EINECS 243-887-1, (phenylmethyl)hydrazine dihydrochloride, AI3-52520, LS-7218, Hydrazine, (phenylmethyl)-, dihydrochloride, 555-96-4

Molecular Formula: C7H12Cl2N2Molecular Weight: 195.089580 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: MSJHOJKVMMEMNX-UHFFFAOYSA-N

• Betaxolol Hcl
IUPAC Name: 1-[4-[2-(cyclopropylmethoxy)ethyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol hydrochloride | CAS Registry Number: 63659-19-8
Synonyms: Betoptic, Kerlone, Betaxolol hydrochloride, Betoptima, Kerlon, betaxolol, Betoptic S, Kerlong, Betaxolol HCL, Betoptic (TN), Prestwick_779, Kerlone (TN), KERLEDEX, BETOPTIC PILO, Betaxolol hydrochloride [USAN], C18H29NO3.HCl, MLS000028464, MLS000758269, MLS000863279, MLS001148209

Molecular Formula: C18H30ClNO3Molecular Weight: 343.888700 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: CHDPSNLJFOQTRK-UHFFFAOYSA-N

• Biformyl
IUPAC Name: oxaldehyde | CAS Registry Number: 107-22-2
Synonyms: Ethanedial, Oxalaldehyde, GLYOXAL, Glyoxylaldehyde, Biformal, Diformal, Diformyl, 1,2-Ethanedione, Oxal, oxypolygelatine, Oxypolygelatin, Ethanedione, Gelifundol, Glyoxal solutions, Glyoxal solution, Ethanedial, trimer, Ethanediol, trimer, Glyoxal, 40%, Aerotex glyoxal 40, Glyoxal, 29.2%

Molecular Formula: C2H2O2Molecular Weight: 58.036080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LEQAOMBKQFMDFZ-UHFFFAOYSA-N

• Butylhydrazine Hydrochloride
IUPAC Name: butylhydrazine hydrochloride | CAS Registry Number: 56795-65-4
Synonyms: n-Butylhydrazine.HCl, butylhydrazine hydrochloride, n-Butylhydrazine hydrochloride, CCRIS 1291, Hydrazine, butyl-, hydrochloride, LS-7242

Molecular Formula: C4H13ClN2Molecular Weight: 124.612420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: GXXOBXPRDUPYEJ-UHFFFAOYSA-N

• CYCLOHEXYLAMINOGLUTETHIMIDE
IUPAC Name: 3-(4-aminophenyl)-3-cyclohexylpiperidine-2,6-dione | CAS Registry Number: 115883-22-2
Synonyms: Nphchexpipone, ChAG, Cyclohexylaminoglutethimide, CHEBI:211108, CID126253, 3-(4-Aminophenyl)-3-cyclohexyl-2,6-piperidinedione, 3-4-Aminophenyl;-3-cyclohexylpiperidine-2,6-dione, 3-(4-Aminophenyl)-3-cyclohexylpiperidine-2,6-dione, 3-Cyclohexyl-3-(4-aminophenyl)-2,6-piperidinedione, 2,6-Piperidinedione, 3-(4-aminophenyl)-3-cyclohexyl-, 3-(4-Amino-phenyl)-3-cyclohexyl-piperidine-2,6-dione, (+)3-(4-Amino-phenyl)-3-cyclohexyl-piperidine-2,6-dione, (+-)-3-(4-Aminophenyl)-3-cyclohexyl-2,6-piperidinedione, (-)3-(4-Amino-phenyl)-3-cyclohexyl-piperidine-2,6-dione, 2,6-Piperidinedione, 3-(4-aminophenyl)-3-cyclohexyl-, (+-)-, 137548-41-5

Molecular Formula: C17H22N2O2Molecular Weight: 286.368780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NTKWRAAWKFNECW-UHFFFAOYSA-N

• Cyclohexylhydrazine hydrochloride
IUPAC Name: cyclohexylhydrazine;hydrochloride | CAS Registry Number: 24214-73-1
Synonyms: 1-cyclohexylhydrazine hydrochloride, cyclohexylhydrazinehydrochloride, Hydrazine, cyclohexyl-, hydrochloride, SBB069608, 30929-57-8, SureCN182141, AC1L4JJ4, AC1Q3DH0, ACMC-1CP91, KSC490O4T, 519774_ALDRICH, Jsp004833, 1-cyclohexylhydrazinehydrochloride, Hydrazinocyclohexane hydrochloride, MolPort-001-768-994, ACT03334, ANW-25363, AR-1I3162, AKOS015848376, AG-C-09663

Molecular Formula: C6H15ClN2Molecular Weight: 150.649700 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: JZRHODNPRNTXKO-UHFFFAOYSA-N

• Cyclopropanecarboxamidine
IUPAC Name: cyclopropanecarboximidamide;hydrochloride | CAS Registry Number: 54070-74-5
Synonyms: cyclopropane-1-carboximidamide hydrochloride, 57297-29-7, Cyclopropanecarboximidamide Hydrochloride, Cyclopropanecarboxamidine HCl, Cyclopropanecarboxamidine Hydrochloride, Cyclopropyl Carbamidine Hydrochloride, SBB028203, PubChem9046, Cyclopropylcarbamidine HCl, cyclopropyl carbamidine hcl, SureCN275450, AC1Q3CR7, ACMC-1B10V, KSC497S9N, AC1MD154, CTK3J7996, MolPort-000-002-502, Clcyopropylcarbamidine hydrochloride, Cyclopropylcarbamidine hydrochloride, ACN-S004636

Molecular Formula: C4H9ClN2Molecular Weight: 120.580660 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 1

InChIKey: JRYOZJIRAVZGMV-UHFFFAOYSA-N

• DCO Fatty Acids
IUPAC Name: (9Z,12Z)-octadeca-9,12-dienoic acid | CAS Registry Number: 60-33-3
Synonyms: linoleic acid, Linolic acid, Telfairic acid, Grape seed oil, Linoleate, Oils, grape, Oils, grape seed, Linoelaidic acid, alpha-Linoleic acid, cis,cis-Linoleic acid, Extra Linoleic 90, Linoleic acid, pure, Emersol 310, Emersol 315, Polylin 515, Polylin No. 515, Unifac 6550, 9Z,12Z-Linoleic acid, 9,12-Linoleic acid, (14C)-Linoleic acid

Molecular Formula: C18H32O2Molecular Weight: 280.445480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OYHQOLUKZRVURQ-HZJYTTRNSA-N

• Dihydro-Furan-3-One     
IUPAC Name: oxolan-3-one | CAS Registry Number: 22929-52-8
Synonyms: 3-Oxotetrahydrofuran, Dihydrofuran-3(2H)-one, Oxolan-3-one, Dihydro-3(2H)-furanone, dihydrofuran-3-one, 3-Oxo-1,4-epoxybutane, 3(2H)-Furanone, dihydro, 3(2H)-Furanone, dihydro-, Tetrahydrofuran-3-yloxy, PubChem15127, AC1Q6EUG, SureCN44273, ACMC-1CNG9, AC1LB55R, TETRAHYDROFURAN-3-ONE, KSC494Q0N, CTK3J4806, HMDB02523, BH767, ANW-24995

Molecular Formula: C4H6O2Molecular Weight: 86.089240 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JLPJFSCQKHRSQR-UHFFFAOYSA-N

• Ethyl 1,3-dimethyl-1H-pyrazole-4-carboxylate
IUPAC Name: ethyl 1,3-dimethylpyrazole-4-carboxylate | CAS Registry Number: 85290-76-2
Synonyms: ethyl 1,3-dimethyl-1H-pyrazole-4-carboxylate, Ethyl 1,3-dimethylpyrazole-4-carboxylate, PubChem23652, SureCN3267578, ethyldimethylpyrazolecarboxylate, STOCK6S-90165, CTK3C9006, MolPort-004-961-683, ACN-C000878, ANW-72371, SBB069261, STK652665, ZINC15919789, AKOS005073586, AB05030, AG-H-43024, MCULE-6183848984, RP10431, AK-41381, KB-50653

Molecular Formula: C8H12N2O2Molecular Weight: 168.193080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UEOAHNKIDQAFPD-UHFFFAOYSA-N

• ethyl 2-amino-3-oxobutanoate hydrochloride
IUPAC Name: ethyl 2-amino-3-oxobutanoate;hydrochloride | CAS Registry Number: 20207-16-3
Synonyms: Butanoic acid, 2-amino-3-oxo-, ethyl ester, hydrochloride, AGN-PC-00LUSM, AC1Q39WA, CTK0J9235, MolPort-005-313-738, ANW-46838, AKOS009235685, AG-C-10646, AK-39799, BR-39799, ETHYL 2-AMINO-3-OXOBUTANOATE HCL, KB-252420, W4269, EN300-40378, I14-12765, Ethyl 2-amino-3-oxobutanoate hydrochloride (1:1);MFCD09971784;Ethyl 2-amino-3-oxobutanoate hydrochloride;

Molecular Formula: C6H12ClNO3Molecular Weight: 181.617380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BGJIQVZAHKXUFG-UHFFFAOYSA-N

• Ethyl 3-(6-Oxopiperidin-3-Yl)Propanoate
IUPAC Name: ethyl 3-(6-oxopiperidin-3-yl)propanoate | CAS Registry Number: 87850-83-7
Synonyms: ethyl 3-(6-oxopiperidin-3-yl)propanoate, AKOS015919280, KB-201505, FT-0652637, ST51054593, A842387, ethyl 3-(6-oxidanylidenepiperidin-3-yl)propanoate, 3-(6-oxo-3-piperidinyl)propanoic acid ethyl ester, S12-0001

Molecular Formula: C10H17NO3Molecular Weight: 199.246880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WIBAJADJMASAIL-UHFFFAOYSA-N

• Ethyl 3-oxocyclobuantecarboxylate
IUPAC Name: ethyl 3-oxocyclobutane-1-carboxylate | CAS Registry Number: 87121-89-9
Synonyms: ethyl 3-oxocyclobutanecarboxylate, 3-OXO-CYCLOBUTANECARBOXYLIC ACID ETHYL ESTER, AG-H-51387, 87121-89-9 ethyl 3-oxocyclobutanecarboxylate, SureCN871448, CTK5F7861, MolPort-015-163-769, Ethyl 3-oxo-cyclobutanecarboxylate, HT484, ANW-73862, ethyl 3-oxocyclobutane-1-carboxylate, AKOS006327278, RP08876, AK-68248, BR-68248, KB-87676, CK-06-016, AM20070625, FT-0657369, W8940

Molecular Formula: C7H10O3Molecular Weight: 142.152500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BXBRFSMPBOTZHJ-UHFFFAOYSA-N

• Ethyl 4-Amino-2-(methylthio)pyrimidine-5-Carboxylate
IUPAC Name: ethyl 4-amino-2-methylsulfanylpyrimidine-5-carboxylate | CAS Registry Number: 776-53-4
Synonyms: ChemDiv3_014680, MLS000554777, NSC9310, STOCK1S-21882, CID222666, ZINC00399498, IDI1_030478, SMR000146894, AF-601/00276042, S03-0005, ethyl 4-amino-2-(methylsulfanyl)-5-pyrimidinecarboxylate, 4-Amino-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester

Molecular Formula: C8H11N3O2SMolecular Weight: 213.256840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: QINRQIZOBCQKAZ-UHFFFAOYSA-N

• Ethyl 4-chloro-2-methylthiopyrimidine-5-carboxylate
IUPAC Name: ethyl 4-chloro-2-methylsulfanylpyrimidine-5-carboxylate | CAS Registry Number: 5909-24-0
Synonyms: 145963_ALDRICH, EINECS 227-619-0, NSC123534, ZINC00119543, 6N-537S, TL8003781, 4-Chloro-5-carbethoxy-2-methylthiopyrimidine, Ethyl 4-chloro-2-methylthio-5-pyrimidinecarboxylate, Ethyl 4-chloro-2-(methylthio)-5-pyrimidinecarboxylate, Ethyl4-chloro-2-(methylthio)-5-pyrimidinecarboxylate, 5-Pyrimidinecarboxylic acid, 4-chloro-2-(methylthio)-, ethyl ester, 4-Chloro-2-methylsulfanyl-pyrimidine-5-carboxylic acid ethyl ester

Molecular Formula: C8H9ClN2O2SMolecular Weight: 232.687260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SNNHLSHDDGJVDM-UHFFFAOYSA-N

• heptylhydrazine hydrochloride (CAS: 79201-42-6)
• hexylhydrazine hydrochloride
IUPAC Name: hexylhydrazine;hydrochloride | CAS Registry Number: 79201-41-5
Synonyms: n-hexylhydrazine hydrochloride, SCHEMBL11349893, S14-2881

Molecular Formula: C6H17ClN2Molecular Weight: 152.665580 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: RRIJZRZUKBIERI-UHFFFAOYSA-N

• HYDRAZINE,PROPYL-,HCL
IUPAC Name: propylaminoazanium chloride | CAS Registry Number: 56795-66-5
Synonyms: Propylhydrazine.HCl, n-Propylhydrazine hydrochloride, propylhydrazine hydrochloride, CCRIS 1303, CID42006, HYDRAZINE, PROPYL-, HYDROCHLORIDE, LS-7682

Molecular Formula: C3H11ClN2Molecular Weight: 110.585840 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VWNFFIGQDGOCIA-UHFFFAOYSA-N

• HYDRAZINECARBOXYLIC ACID 2-CYCLOPENTYL-,TERT-BUTYL ESTER
IUPAC Name: tert-butyl N-(cyclopentylamino)carbamate | CAS Registry Number: 646071-31-0
Synonyms: tert-Butyl 2-Cyclopentylhydrazinecarboxylate, SBB056257, SureCN573789, CTK2A4710, MolPort-004-784-832, ZINC39091286, AKOS016011351, AG-C-18839, AK120667, KB-260307, (tert-butoxy)-N-(cyclopentylamino)carboxamide, S14-2961, Hydrazinecarboxylic acid, 2-cyclopentyl-, 1,1-dimethylethyl ester

Molecular Formula: C10H20N2O2Molecular Weight: 200.278000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JQQJGTQKMJCMGT-UHFFFAOYSA-N

• HYDRAZINECARBOXYLIC ACID, 2-CYCLOHEXYL-, 1,1-DIMETHYLETHYL ESTER
IUPAC Name: tert-butyl N-(cyclohexylamino)carbamate | CAS Registry Number: 60295-21-8
Synonyms: SCHEMBL1863269, MolPort-035-699-644, AM805887, TERT-BUTYL 2-CYCLOHEXYLHYDRAZINECARBOXYLATE, S14-2960, N'-cyclohexyl-hydrazine carboxylic acid tert-butyl ester

Molecular Formula: C11H22N2O2Molecular Weight: 214.304580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: SMESSKMLHMZMQX-UHFFFAOYSA-N

• isobutylhydrazine hydrochloride
IUPAC Name: 2-methylpropylhydrazine;hydrochloride | CAS Registry Number: 145295-89-2
Synonyms: 237064-47-0, 2-methylpropylhydrazine hydrochloride, (2-methylpropyl)hydrazine hydrochloride, 2-methylpropylhydrazinehydrochloride, sOTHHaDHMmUP@, 42504-87-0, PubChem18739, AC1MC3WZ, ACMC-1CGG5, Ambpe2002826, ISOBUTYLHYDRAZINE HCL, SCHEMBL519781, (2-Methylpropyl)-hydrazine hcl, CTK7F1934, DTXSID80375460, DGOQIJKUNBFISY-UHFFFAOYSA-N, MolPort-000-159-490, 2-methylpropyldiazane hydrochloride, ANW-67834, EBD210713

Molecular Formula: C4H13ClN2Molecular Weight: 124.612 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: DGOQIJKUNBFISY-UHFFFAOYSA-N

• Isopropylhydrazine hydrochloride
IUPAC Name: propan-2-ylhydrazine hydrochloride | CAS Registry Number: 16726-41-3
Synonyms: Isopropylhydrazine monohydrochloride, CID85573, EINECS 240-784-3, Hydrazine, (1-methylethyl)-, monohydrochloride, 2257-52-5

Molecular Formula: C3H11ClN2Molecular Weight: 110.585840 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: ILULYDJFTJKQAP-UHFFFAOYSA-N

• ISOPROPYLTHIOCYANATE
IUPAC Name: propan-2-yl thiocyanate | CAS Registry Number: 625-59-2
Synonyms: isopropyl thiocyanate, NSC60538, MolPort-000-156-681, CID246911, ZINC01690285, S14-1059, InChI=1/C4H7NS/c1-4(2)6-3-5/h4H,1-2H

Molecular Formula: C4H7NSMolecular Weight: 101.170080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CUABTFPYLQSPAE-UHFFFAOYSA-N

• m-Isopropylphenol
IUPAC Name: 3-propan-2-ylphenol | CAS Registry Number: 618-45-1
Synonyms: 3-Isopropylphenol, m-Cumenol, Phenol, m-isopropyl-, m-Isopropyl-phenol, M-ISOPROPYLPHENOL, Phenol, isopropylated, Phenol, 3-(1-methylethyl)-, 3-Isopropylhydroxybenzene, Mixed isopropyl phenols, ISOPROPYLPHENOL, META, 479667_ALDRICH, NSC 2209, 59724_FLUKA, EINECS 210-551-0, NSC2209, AIDS017742, AIDS-017742, BRN 2040880, EINECS 291-826-2, ZINC01577204

Molecular Formula: C9H12OMolecular Weight: 136.190980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VLJSLTNSFSOYQR-UHFFFAOYSA-N

• Methyl 3-methylpyridine-2-carboxylate
IUPAC Name: methyl 3-methylpyridine-2-carboxylate | CAS Registry Number: 59718-84-2
Synonyms: METHYL 3-METHYLPICOLINATE, 3-Methylpicolinic acid methyl ester, 3-Methylpicolinic acid, methyl ester, Methyl3-methylpyridine-2-carboxylate, AG-G-13030, ACMC-1ATXG, Methyl 3-methylpicolinate,, SureCN128711, KSC495K1B, 681954_ALDRICH, CTK3J5510, MolPort-004-763-000, ANW-33329, SBB068950, ZINC02511443, AKOS011625751, AB16147, AK-61199, KB-54172, AB1005861

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CCQFKEITVOTHIW-UHFFFAOYSA-N

• MINAMESTANE
IUPAC Name: (8R,9S,10R,13S,14S)-4-amino-10,13-dimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthrene-3,17-dione | CAS Registry Number: 105051-87-4
Synonyms: Minamestane, Minamestano, Minamestanum, Minamestane [INN], Minamestanum [INN-Latin], Minamestano [INN-Spanish], Fce 24928, CID65886, FCE-24928, I06-2163

Molecular Formula: C19H23NO2Molecular Weight: 297.391420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DAKHYLIFCYPHQW-KZQROQTASA-N

• N-(2-Nitrobenzyl)pyrrole-2-carboxaldehyde
IUPAC Name: 1-[(2-nitrophenyl)methyl]pyrrole-2-carbaldehyde | CAS Registry Number: 22162-51-2
Synonyms: 1-(2-nitrobenzyl)-1H-pyrrole-2-carbaldehyde, 1-[(2-nitrophenyl)methyl]pyrrole-2-carbaldehyde, SBB057925, ZINC00156370, AC1LEHMF, MLS000677165, AC1Q205Q, CTK4E8802, MolPort-002-229-457, HMS2615D10, KST-1B1821, AR-1B1069, BBL015256, STK320347, AKOS000411370, AG-E-62121, AM84790, MCULE-5058323350, AK110867, KB-63869

Molecular Formula: C12H10N2O3Molecular Weight: 230.219400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AKFAPUIPEQSHJL-UHFFFAOYSA-N

• N-Boc-2-amino-5-bromothiazole
IUPAC Name: tert-butyl N-(5-bromo-1,3-thiazol-2-yl)carbamate | CAS Registry Number: 405939-39-1
Synonyms: N-Boc-2-Amino-5-bromothiazole, tert-butyl 5-bromothiazol-2-ylcarbamate, tert-butyl N-(5-bromo-1,3-thiazol-2-yl)carbamate, PubChem8907, MolPort-003-823-882, ZINC08698450, AKOS000282826, AB32049, ACN-000935, QC-6371, RP29805, AK-21805, BR-21805, EN000351, tert-Butyl (5-bromothiazol-2-yl)carbamate, FT-0646197, ST51053581, W6110, tert-butyl 5-bromo-1,3-thiazol-2-ylcarbamate, I09-0941

Molecular Formula: C8H11BrN2O2SMolecular Weight: 279.154140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OIBKBVFFZYCBAQ-UHFFFAOYSA-N

• N-Boc-trans-4-fluoro-L-proline
IUPAC Name: (2S,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid | CAS Registry Number: 203866-14-2
Synonyms: Boc-trans-4-Fluoro-L-proline, (2S,4R)-1-(tert-butoxycarbonyl)-4-fluoropyrrolidine-2-carboxylic acid, N-(tert-Butoxycarbonyl)-(2S,4R)-4-fluoroproline, (2S,4R)-1-Boc-4-fluoro-2-pyrrolidinecarboxylic Acid, trans-4-Fluoro-L-proline, N-BOC protected, (2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoro-2-pyrrolidinecarboxylic Acid, N-(tert-Butoxycarbonyl)-trans-4-fluoro-L-proline, (2S,4R)-4-Fluoropyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, (2S,4R)-1-(tert-Butoxycarbonyl)-4-fluoropyrrolidine-2-carboyxlic acid, N-BOC protected, PubChem15704, N-Boc-(4S,2R)-4-fluoro-2-pyrrolidinecarboxylic acid, SureCN192501, KSC498E4R, CTK3J8248, MolPort-003-725-591, BOC-TRANS-4-FLUORO-PRO-OH, ANW-24055, PC2200, AKOS005762889

Molecular Formula: C10H16FNO4Molecular Weight: 233.236743 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: YGWZXQOYEBWUTH-RQJHMYQMSA-N

• N-Butyl-N-Chloro-1-Butanamine
IUPAC Name: N-butyl-N-chlorobutan-1-amine | CAS Registry Number: 999-33-7
Synonyms: N-BUTYL-N-CHLORO-1-BUTANAMINE, N-butyl-N-chlorobutan-1-amine, NSC223056, AC1L22KW, N-butyl-N-chloro-butan-1-amine, N-butyl-N-chloranyl-butan-1-amine, ZINC01756716, NSC-223056, FT-0653300, ST51056573, A846105, S14-0914

Molecular Formula: C8H18ClNMolecular Weight: 163.688220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QZYWEVKTBJKUPB-UHFFFAOYSA-N

• N-NITROSODIMETHYLAMINE
IUPAC Name: N,N-dimethylnitrous amide | CAS Registry Number: 62-75-9
Synonyms: Dimethylnitrosamine, Dimethylnitrosoamine, Nitrosodimethylamine, Dimethylnitrosamin, DMNA, NDMA, N,N-Dimethylnitrosamine, nitrous dimethylamide, N-Nitroaodimethylamine, N-Dimethyl-nitrosamine, N-Methyl-N-nitrosomethanamine, Nitrosamine, dimethyl-, Methanamine, N-methyl-N-nitroso-, Dimethylamine, N-nitroso-, N-dimethylnitrosoamine, N Nitrosodimethylamine, N-Nitroso-N,N-dimethylamine, RCRA waste no. P082, RCRA waste number P082, Dimethylnitrosamin [German]

Molecular Formula: C2H6N2OMolecular Weight: 74.081840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UMFJAHHVKNCGLG-UHFFFAOYSA-N

• OCTAMOXIN
IUPAC Name: octan-2-ylhydrazine | CAS Registry Number: 4684-87-1
Synonyms: Octamoxin, Octamoxine, Octamoxina, Octamoxinum, Octamoxine [INN-French], Octamoxinum [INN-Latin], (1-Methylheptyl)hydrazine, Octamoxina [INN-Spanish], Octamoxin [INN:DCF], UNII-0HXY3M6S54, C8H20N2, MolPort-005-260-277, HYDRAZINE, (1-METHYLHEPTYL)-, CID20811, BRN 1734911, LS-76877, 0-04-00-00552 (Beilstein Handbook Reference)

Molecular Formula: C8H20N2Molecular Weight: 144.257800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FODQIVGFADUBKE-UHFFFAOYSA-N

• P - Toluamide
IUPAC Name: 4-methylbenzamide | CAS Registry Number: 619-55-6
Synonyms: p-Toluamide, 4-Methylbenzamide, p-Methylbenzamide, Benzamide, 4-methyl-, 4-Methyl-benzamide, 260797_ALDRICH, NSC 2163, EINECS 210-600-6, NSC2163, SBB007862, ZINC00080859, FR-0473, LS-27170, TL8003992, InChI=1/C8H9NO/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H2,9,10

Molecular Formula: C8H9NOMolecular Weight: 135.163160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UHBGYFCCKRAEHA-UHFFFAOYSA-N

• P-DIAZOBENZENESULFONIC ACID WET WITH WATER
IUPAC Name: 4-diazoniobenzenesulfonate | CAS Registry Number: 305-80-6
Synonyms: p-Diazobenzenesulfonic acid, 4-diazoniobenzenesulfonate, 4-Diazobenzenesulphonic acid, 2154-66-7 (Parent), CHEBI:212460, CID67539, EINECS 206-168-3, ZINC05842269, Benzenediazonium, 4-sulfo-, inner salt, Toluene-1-diazonium-4-sulfonic acid anion, S01-0487, 631-98-1, 86801-03-8

Molecular Formula: C6H4N2O3SMolecular Weight: 184.172560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UEUIKXVPXLWUDU-UHFFFAOYSA-N

• P-methoxy-phenylhydrazine-hydrochloride
IUPAC Name: (4-methoxyphenyl)hydrazine | CAS Registry Number: 19501-58-7
Synonyms: p-Anisylhydrazine, 4-methoxyphenylhydrazine, (p-Methoxyphenyl)hydrazine, (4-Methoxyphenyl)hydrazine, Hydrazine, (4-methoxyphenyl)-, NCIOpen2_001056, ZERO/004587, EINECS 222-439-9, ZINC00088604, TL8001602, 3471-32-7

Molecular Formula: C7H10N2OMolecular Weight: 138.167100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: PVRSIFAEUCUJPK-UHFFFAOYSA-N

• P-Methylphenylhydrazine Hydrochloride
IUPAC Name: (4-methylphenyl)hydrazine hydrochloride | CAS Registry Number: 637-60-5
Synonyms: p-Tolylhydrazine hydrochloride, 4-Methylphenylhydrazine hydrochloride, WLN: ZMR D1 &GH, T40606_ALDRICH, p-Tolylhydrazinium(1+) chloride, NSC 2112, 90120_FLUKA, EINECS 211-295-2, HYDRAZINE, p-TOLYL-, HYDROCHLORIDE, NSC2112, Hydrazine, p-tolyl-, monohydrochloride, CID12504, BTB 07632, 4-Methylphenylhydrazine monohydrochloride, Hydrazine, (4-methylphenyl)-, monohydrochloride, LS-76980, Hydrazine, (4-methylphenyl)-, hyrochloride, TL8004480, Hydrazine, p-tolyl-, monohydrochloride (8CI), 35467-65-3

Molecular Formula: C7H11ClN2Molecular Weight: 158.628640 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: HMHWNJGOHUYVMD-UHFFFAOYSA-N

• Pentylhydrazine hydrochloride
IUPAC Name: pentylhydrazine;hydrochloride | CAS Registry Number: 1119-68-2
Synonyms: pentylhydrazine hydrochloride, n-Pentylhydrazine.HCl, n-Pentylhydrazine hydrochloride, 2656-71-5, AC1NR4G4, CTK8H9097, KB-58742, S14-2880

Molecular Formula: C5H15ClN2Molecular Weight: 138.639000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 2

InChIKey: OUHMCZPSMWROKK-UHFFFAOYSA-N

• Propanamide, 3-[4-(acetylamino)phenoxy]-2-Hydroxy-2-Methyl-N-[4-Nitro-3-(trifluoromethyl)phenyl]-, (2s)-
IUPAC Name: (2S)-3-(4-acetamidophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide | CAS Registry Number: 401900-40-1
Synonyms: Andarine, GTX007, GTX-007, 401900-40-1, S-3-(4-Acetylamino-phenoxy)-2-hydroxy-2-methyl-n-(4-nitro-3-trifluoromethyl-phenyl)-propionamide, S-4, S1140_Selleck, Andarine (GTX-007), Andarine - GTX-007, UNII-7UT2HAH49H, SureCN2689756, cc-483, Nonsteroidal AR Ligand, S-6, CHEMBL125236, GTX-007, 3b68, BCPP000400, ABP000375, ABP000949, ZINC03991693, AKOS005145785

Molecular Formula: C19H18F3N3O6Molecular Weight: 441.357930 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: YVXVTLGIDOACBJ-SFHVURJKSA-N

• Quinoxaline, 7-bromo-2-chloro-
IUPAC Name: 7-bromo-2-chloroquinoxaline | CAS Registry Number: 89891-65-6
Synonyms: 7-bromo-2-chloroquinoxaline, Quinoxaline,7-bromo-2-chloro-, SBB014165, AG-H-67435, ZERO/008387, PubChem18353, ACMC-209z6a, AC1NKH37, CTK5G7092, MolPort-002-742-966, 7-bromanyl-2-chloranyl-quinoxaline, ANW-49856, STK785174, WTI-10292, ZINC04344022, AKOS005620591, AB12778, MCULE-5722436108, RP28614, QUINOXALINE, 7-BROMO-2-CHLORO-

Molecular Formula: C8H4BrClN2Molecular Weight: 243.487760 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AZUMKBQKUXTHCM-UHFFFAOYSA-N

• S-2--Bromobutyric Acid
IUPAC Name: (2S)-2-bromobutanoic acid | CAS Registry Number: 32659-49-7
Synonyms: S-2--bromobutyric acid, (S)-2-Bromobutanoic acid, PubChem8279, AC1LCVPO, L-2-Bromobutyric acid, S-2-Bromobutyric acid, L-2-Bromobutanoic acid, (S)-2-Bromobutyric acid, UNII-XK125R6KHN, (2S)-2-bromobutanoic acid, alpha-Bromobutyric acid, (S)-, alpha-Bromobutyric acid, (-)-, AM81433, AK-48842, KB-60372, I04-0899, InChI=1/C4H7BrO2/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H,6,7

Molecular Formula: C4H7BrO2Molecular Weight: 167.001180 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YAQLSKVCTLCIIE-VKHMYHEASA-N

• sec-butylhydrazine dihydrochloride
IUPAC Name: butan-2-ylhydrazine;dihydrochloride | CAS Registry Number: 1177361-36-2
Synonyms: sec-Butylhydrazine dihydrochloride, butan-2-ylhydrazine dihydrochloride, AC1Q3A9I, CTK6C9451, MolPort-016-580-513, SBB087495, AKOS015901624, but-2-ylhydrazine, chloride, chloride, AG-C-09605, AM803011, KB-104939, FT-0684473, EN300-56931, I14-14036

Molecular Formula: C4H14Cl2N2Molecular Weight: 161.073360 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: LKAMBWQCMVFVEE-UHFFFAOYSA-N

• Tert-Butyl Carbazate
IUPAC Name: tert-butyl N-aminocarbamate | CAS Registry Number: 870-46-2
Synonyms: tert-Butyl carbazate, Boc-hydrazide, t-Butylcarbazate, tert-Butoxycarbonyl hydrazide, (tert-Butoxycarbonyl)hydrazine, Carbazic acid, tert-butyl ester, tert-Butyloxycarbonylhydrazide, B91005_ALDRICH, tert-Butyl hydrazinecarboxylate, 19740_FLUKA, hydrazine carboxylic acid T-butyl, NSC60250, EINECS 212-795-3, NSC 60250, STK074844, ZINC00154656, Hydrazinecarboxylic acid, tert-butyl ester, Hydrazinecarboxylic acid, 1,1-dimethylethyl ester, AI3-62061, TL8005650

Molecular Formula: C5H12N2O2Molecular Weight: 132.160980 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: DKACXUFSLUYRFU-UHFFFAOYSA-N

• Tetrahydro-4-hydroxy-2H-pyran-4-carboxylic acid methyl ester
IUPAC Name: methyl 4-hydroxyoxane-4-carboxylate | CAS Registry Number: 115996-72-0
Synonyms: methyl 4-hydroxy-tetrahydro-2H-pyran-4-carboxylate, methyl 4-hydroxyoxane-4-carboxylate, Methyl 4-hydroxytetrahydro-2H-pyran-4-carboxylate, AGN-PC-00O9AA, CTK8C1638, MolPort-012-675-245, ANW-67010, methyl 4-oxidanyloxane-4-carboxylate, RW4059, ZINC32915124, AKOS011495736, MCULE-2689620350, RP22329, AK-90181, KB-54398, FT-0657900, ST51054634, 4-hydroxy-4-oxanecarboxylic acid methyl ester, A803541, S14-0078

Molecular Formula: C7H12O4Molecular Weight: 160.167780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YMKUGBABAIVMLG-UHFFFAOYSA-N

• Tos-Phe-OH
IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid | CAS Registry Number: 13505-32-3
Synonyms: NCIOpen2_009805, Oprea1_534866, MLS000776584, ZERO/006235, ALBB-006226, CID309599, NSC211907, SMR000371829, EU-0000301, 2-{[(4-methylphenyl)sulfonyl]amino}-3-phenylpropanoic acid

Molecular Formula: C16H17NO4SMolecular Weight: 319.375480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: CGRCVIZBNRUWLY-UHFFFAOYSA-N


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