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Shanghai Sinch Pharmaceuticals Tech. Co., Ltd.

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Profile: Shanghai Sinch Pharmaceuticals Tech. Co., Ltd. is a provider of building blocks and API intermediates. Our building blocks include heterocyclic carboxylic acids & esters, polyfunctional pyrimidines, pyridines, activated aryl chlorides, unnatural amino acids, secondary amines, porphyrins & porphines, nucleosides, aldehydes and ketones. Our heterocyclic carboxylic acids & esters include 7-bromobenzo[d][1,3]dioxole-5-carboxylic acid, benzofuran-7-carboxylic acid, pyrano[4,3-c]pyrazole-3-carboxylic acid, 1,4,6,7-tetrahydro-, 6H-pyrazolo[3,4-c]pyridine-3,6-dicarboxylic acid, 1,4,5,7-tetrahydro-, 6-(1,1-dimethylethyl) ester and 7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic acid.

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• 1-(gamma-Bromopropoxy)-4-Nitrobenzene
IUPAC Name: 1-(3-bromopropoxy)-4-nitrobenzene | CAS Registry Number: 13094-50-3
Synonyms: NCIOpen2_005819, 4-(3-Bromopropoxy)nitrobenzene, NSC93035, CID261128, ZINC01603963, BBV-1774207, D1209

Molecular Formula: C9H10BrNO3Molecular Weight: 260.084600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LIBYGKUWXRBMPA-UHFFFAOYSA-N

• 1,1,1,2,2,3,3-Heptafluoro-5-Iodopentane
IUPAC Name: 1,1,1,2,2,3,3-heptafluoro-5-iodopentane | CAS Registry Number: 1513-88-8
Synonyms: 1,1,1,2,2,3,3-Heptafluoro-5-iodopentane, 1H,1H,2H,2H-Perfluoropentyl iodide, 68188-12-5, Perfluoroalkyl(C2-C18)ethyl iodide, AC1Q4HVD, heptafluoro-5-iodopentane, ACMC-1BO3U, AC1L36HI, 54248_ALDRICH, 2-(Perfluoropropyl)ethyl iodide, 54248_FLUKA, CTK4C7029, PC4496U, 1-Iodo-2-(perfluoropropyl)ethane, MolPort-000-156-202, KST-1B7551, EINECS 269-141-5, Perfluoro-C2-18-alkylethyl iodides, AR-1B3682, AKOS015852827

Molecular Formula: C5H4F7IMolecular Weight: 323.978552 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: TZNRRNKRZXHADL-UHFFFAOYSA-N

• 4-Cyanophenylthiourea
IUPAC Name: (4-cyanophenyl)thiourea | CAS Registry Number: 3460-55-7
Synonyms: (4-Cyanophenyl)thiourea, 4-cyanophenylthiourea, 1-(4-cyanophenyl)thiourea, 1-(4-Cyanophenyl)-2-thiourea, ST50825102, ZINC00156319, AC1MBX3I, ACMC-1AJD4, Thiourea,N-(4-cyanophenyl)-, 654744_ALDRICH, CTK4H2703, MolPort-000-153-729, AC1Q5031, AKOS005207158, AG-A-04854, MCULE-6410792321, KB-84877, FT-0618309, EN300-61169, 4-[(aminothioxomethyl)amino]benzenecarbonitrile

Molecular Formula: C8H7N3SMolecular Weight: 177.226280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LFMJROANUIRGBS-UHFFFAOYSA-N

• 1,22a-Dihydro-1,2-Bis(methoxycarbonyl)-19-(1-Methoxyethyl)-8,14,18,22a-Tetramethyl-23H,25H-Benzo[b]porphine-9,13-Dipropanoic Acid
Synonyms: 1,22a-Dihydro-1,2-bis(methoxycarbonyl)-19-(1-methoxyethyl)-8,14,18,22a-tetramethyl-23H,25H-benzo[b]porphine-9,13-dipropanoic acid

Molecular Formula: C41H44N4O9Molecular Weight: 736.822 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 11

InChIKey: DLXFUANOURMYAN-UHFFFAOYSA-N

• (2-AMINO-ETHYL)-UREA X HCL
IUPAC Name: 2-aminoethylurea hydrochloride | CAS Registry Number: 858001-69-1
Synonyms: MolPort-002-499-278, 1-(2-Aminoethyl)urea hydrochloride

Molecular Formula: C3H10ClN3OMolecular Weight: 139.584000 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: GAAFPTWQUBAULJ-UHFFFAOYSA-N

• (2-AMINOETHYL)-BENZYL CARBAMIC ACID TERT-BUTYL ESTER
IUPAC Name: tert-butyl N-(2-aminoethyl)-N-benzylcarbamate | CAS Registry Number: 152193-00-5
Synonyms: (2-Aminoethyl)-Benzyl Carbamic Acid Tert-Butyl Ester, tert-butyl (2-aminoethyl)benzylcarbamate, tert-Butyl (2-aminoethyl)(benzyl)carbamate, tert-butyl N-(2-aminoethyl)-N-benzylcarbamate, (2-Aminoethyl)benzyl carbamic acid tert-butyl ester, Carbamic acid,N-(2-aminoethyl)-N-(phenylmethyl)-, 1,1-dimethylethyl ester, AC1MC3UN, AC1Q1MRE, ACMC-20a32d, Ambpe2001967, SureCN1231760, CTK4C7345, MolPort-000-159-473, ANW-54899, SBB100786, AKOS009158329, AG-D-99394, AK-91748, KB-82659, (2-aminoethyl)-benzyl carbamic acid tert-butyl

Molecular Formula: C14H22N2O2Molecular Weight: 250.336680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NFGJZHRLYRSRPU-UHFFFAOYSA-N

• (3-AMINOPROPYL)DIMETHYLMETHOXYSILANE
IUPAC Name: 3-[methoxy(dimethyl)silyl]propan-1-amine | CAS Registry Number: 31024-26-7
Synonyms: (3-Aminopropyl)dimethylmethoxysilane, 3-[methoxy(dimethyl)silyl]propan-1-amine, AC1MBZLX, 3-aminopropyldimethylmethoxysilane, CTK4G6295, (3-Aminopropyl)dimethyl methoxysilane, AKOS006341300, 1-Propanamine,3-(methoxydimethylsilyl)-, 3-[methoxy(dimethyl)silyl]-1-propanamine, KB-01429, FT-0691163, A820692, I14-18758

Molecular Formula: C6H17NOSiMolecular Weight: 147.290780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MCLXOMWIZZCOCA-UHFFFAOYSA-N

• 1-(4-PHENYLBUTYL)-PIPERAZINE 99%
IUPAC Name: 1-(4-phenylbutyl)piperazine | CAS Registry Number: 97480-93-8
Synonyms: 1-(4-phenylbutyl)piperazine, 1-(4-Phenylbutyl)-piperazine, MolPort-000-158-203, OR4171, CID2737126

Molecular Formula: C14H22N2Molecular Weight: 218.337880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OHFQSNUBVNIZRV-UHFFFAOYSA-N

• 1-(5-NONYL)-PIPERAZINE
IUPAC Name: 1-nonan-5-ylpiperazine | CAS Registry Number: 83655-59-8
Synonyms: AmbitU0287, 1-nonan-5-ylpiperazine, 1-(5-Nonyl)-piperazine, MolPort-000-157-844, CID2760244

Molecular Formula: C13H28N2Molecular Weight: 212.374820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CZWMOMPWEKTUJW-UHFFFAOYSA-N

• (1-BENZYL-1H-IMIDAZOL-2YL-)-ACETIC ACID
IUPAC Name: 2-(1-benzylimidazol-2-yl)acetic acid | CAS Registry Number: 123566-33-6
Synonyms: 1H-Imidazole-2-aceticacid, 1-(phenylmethyl)-, ACMC-20mqnj, SureCN4851345, CHEMBL164135, CTK0H0279, AKOS015996515, AG-A-00656, (1-Benzyl-1H-imidazol-2-yl)aceticacid, (1-Benzyl-1H-imidazol-2yl)acetic acid, (1-benzyl-1h-imidazol-2-yl)acetic acid, (1-Benzyl-1H-imidazol-2yl-)-acetic acid, KB-205050, 2-[1-(phenylmethyl)-2-imidazolyl]acetic acid, 2-[1-(phenylmethyl)imidazol-2-yl]ethanoic acid, A805119

Molecular Formula: C12H12N2O2Molecular Weight: 216.235880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PEXJLERUJWJFKU-UHFFFAOYSA-N

• (2R)-1-methyl-2-Piperidinecarboxylic acid
IUPAC Name: (2R)-1-methylpiperidine-2-carboxylic acid | CAS Registry Number: 41447-17-0
Synonyms: (R)-1-Methylpiperidine-2-carboxylic acid, SureCN58093, CTK8B4992, ANW-46965, AK-80986, KB-209595, W6183

Molecular Formula: C7H13NO2Molecular Weight: 143.183620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BPSLZWSRHTULGU-ZCFIWIBFSA-N

• 1-(5-Ethyl-2-hydroxyphenyl)-3-(4-chlorophenyl)-1,3-propanedione
IUPAC Name: 1-(4-chlorophenyl)-3-(5-ethyl-2-hydroxyphenyl)propane-1,3-dione | CAS Registry Number: 328925-71-9
Synonyms: 1-(4-chlorophenyl)-3-(5-ethyl-2-hydroxyphenyl)propane-1,3-dione, 1-(5-ethyl-2-hydroxyphenyl)-3-(4-chlorophenyl)-1,3-propanedione, AC1MBZ2Y, CTK6D1163, AG-A-15320, 1-(5-Ethyl-2-hydroxyphenyl)-3-(4-chlorophenyl), 1-(5-Ethyl-2-hydroxyphenyl)-3-(4-chlorophenyl)-1, 3-propanedione

Molecular Formula: C17H15ClO3Molecular Weight: 302.752200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MMODSOIJHZFRTG-UHFFFAOYSA-N

• 2,3-dihydrobenzofuran-6-carboxylic acid
IUPAC Name: 2,3-dihydro-1-benzofuran-6-carboxylic acid | CAS Registry Number: 301836-57-7
Synonyms: 2,3-dihydrobenzofuran-6-carboxylicacid, 6-Benzofurancarboxylicacid, 2,3-dihydro-, AGN-PC-01VPH6, SureCN4685014, CTK1C1448, MolPort-009-197-448, ANW-75266, SBB067370, AKOS006304982, AG-E-98931, RP22695, AK-29112, KB-16943, 2,3-dihydro-1-benzofuran-6-carboxylic acid, FT-0646105, A820250, I14-3033

Molecular Formula: C9H8O3Molecular Weight: 164.158020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GOWYEADOSDCIEF-UHFFFAOYSA-N

• 7-bromobenzo[d][1,3]dioxole-5-carboxylic acid
IUPAC Name: 7-bromo-1,3-benzodioxole-5-carboxylic acid | CAS Registry Number: 66799-93-7
Synonyms: SBB067346, 7-bromo-1,3-benzodioxole-5-carboxylic acid, 7-bromo-2H-1,3-benzodioxole-5-carboxylic acid, 5-Bromopiperonylicacid;, AC1NHF75, AC1Q72YK, CTK2F1806, MolPort-000-874-461, AKOS002664808, AG-C-08923, MCULE-3220138071, AK-30106, KB-199903, 1,3-Benzodioxole-5-carboxylicacid, 7-bromo-, EN300-53973, 7-bromanyl-1,3-benzodioxole-5-carboxylic acid, A835550, I14-2990, T6563945, 7-bromo-2H-benzo[d]1,3-dioxolane-5-carboxylic acid

Molecular Formula: C8H5BrO4Molecular Weight: 245.026900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: HLQBEIBAXJNCPT-UHFFFAOYSA-N

• 2-nitropyrimidin-5-ol
IUPAC Name: 2-nitropyrimidin-5-ol | CAS Registry Number: 345642-85-5
Synonyms: 2-nitro-5-pyrimidinol, CTK8I3305, AKOS006304984, AK-27271, KB-25763, FT-0645447, ST51052575, A822276, I03-0224

Molecular Formula: C4H3N3O3Molecular Weight: 141.084920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: OLVAQPRNKRUIRM-UHFFFAOYSA-N

• 5-(benzyloxy)-2-chloropyrimidine
IUPAC Name: 2-chloro-5-phenylmethoxypyrimidine | CAS Registry Number: 138274-14-3
Synonyms: 2-CHLORO-5-(PHENYLMETHOXY)-PYRIMIDINE, AG-D-77499, Pyrimidine,2-chloro-5-(phenylmethoxy)-, ACMC-1C6L6, KSC521C7P, CTK4C1177, MolPort-009-197-191, 2-chloro-5-phenylmethoxypyrimidine, 5-(Benzyloxy)-2-chloropyrimidine;, ANW-51006, SBB067334, ZINC40448319, 2-chloranyl-5-phenylmethoxy-pyrimidine, AKOS015839400, RP27281, AK-25004, BR-25004, KB-40987, FT-0648379, W3013

Molecular Formula: C11H9ClN2OMolecular Weight: 220.654960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XOCCSJLRSSDCLM-UHFFFAOYSA-N

• 4-chloro-5-fluoropyrimidin-2-amine
IUPAC Name: 4-chloro-5-fluoropyrimidin-2-amine | CAS Registry Number: 1683-75-6
Synonyms: 2-Amino-4-chloro-5-fluoropyrimidine, 4-Chloro-5-fluoro-2-pyrimidinamine, Pyrimidine, 2-amino-4-chloro-5-fluoro- (7CI,8CI), AC1LBWCB, ACMC-20a0qu, CTK8B6004, MolPort-004-759-535, 5-Fluoro-4-chloro-2-aminopyrimidine, ANW-51892, SBB070013, ZINC31176453, AKOS005064110, AM84579, QC-7153, RP21177, AK-27275, BR-27275, 4-chloranyl-5-fluoranyl-pyrimidin-2-amine, KB-125107, WT-130860

Molecular Formula: C4H3ClFN3Molecular Weight: 147.538123 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JJSZXRDRSOBWAD-UHFFFAOYSA-N

• 2-Bromo-5-chloropyridine
IUPAC Name: 2-bromo-5-chloropyridine | CAS Registry Number: 40473-01-6
Synonyms: TPC-PY102, ZINC00330764, CID817098, ST5408864, TL8002944, AC-907/25004332

Molecular Formula: C5H3BrClNMolecular Weight: 192.441020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BZUUVQCSPHPUQA-UHFFFAOYSA-N

• 1,2,2-Tribromo-3,3,3-trifluoropropane
IUPAC Name: 2,2,3-tribromo-1,1,1-trifluoropropane | CAS Registry Number: 421-90-9
Synonyms: 2,2,3-tribromo-1,1,1-trifluoropropane, AC1MD2PJ, CTK4I5823, MolPort-000-158-734, AKOS000313712, AG-F-50028, MCULE-4186222025, PC10070, 2,2,3-Tribromo-1,1,1-trifluoropropane;, FT-0632112, Propane,2,2,3-tribromo-1,1,1-trifluoro-, ST45021430, A825801, 2,2,3-tris(bromanyl)-1,1,1-tris(fluoranyl)propane, I14-25886

Molecular Formula: C3H2Br3F3Molecular Weight: 334.755190 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YMHRWWVEJJQVIB-UHFFFAOYSA-N

• 3-Amino-2-pyridine sulfonic acid
IUPAC Name: 3-aminopyridine-2-sulfonic acid | CAS Registry Number: 54247-51-7
Synonyms: NSC302583, CID327449

Molecular Formula: C5H6N2O3SMolecular Weight: 174.177740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PKOFAHAZXCUHLA-UHFFFAOYSA-N

• 6-Bromonicotinic acid
IUPAC Name: 6-bromopyridine-3-carboxylic acid | CAS Registry Number: 6311-35-9
Synonyms: 6-Bromo Nicotinic Acid, TPC-PY045, 646989_ALDRICH, NSC43545, MO 01211, AI-942/13331025

Molecular Formula: C6H4BrNO2Molecular Weight: 202.005460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: JDJBRMNTXORYEN-UHFFFAOYSA-N

• 1-(3-Nitrophenyl)-2-thiourea
IUPAC Name: (3-nitrophenyl)thiourea | CAS Registry Number: 709-72-8
Synonyms: AIDS114921, AIDS-114921, NSC407996, ZINC01600237, ST5171236, Amino[(3-nitrophenyl)amino]methane-1-thione

Molecular Formula: C7H7N3O2SMolecular Weight: 197.214380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: HQEMUQNZGCZHHN-UHFFFAOYSA-N

• 3-Amino-4-pyridinecarboxylic acid
IUPAC Name: 3-aminopyridine-4-carboxylic acid | CAS Registry Number: 7579-20-6
Synonyms: 3-Aminoisonicotinic acid, 3-Amino-isonicotinic acid, Oprea1_716398, MLS000736244, TPC-PY004, TPC-PY062, AIDS020455, 4-Pyridinecarboxylic acid, 3-amino-, AIDS-020455, ALBB-008671, 3-Amino-4-Pyridine Carboxylic Acid, CID459531, EC-000.1274, SMR000338494, TL8006949, AF-807/00322064, A3120/0132113

Molecular Formula: C6H6N2O2Molecular Weight: 138.124040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FYEQKMAVRYRMBL-UHFFFAOYSA-N

• 4-Amino-2-bromopyridine
IUPAC Name: 2-bromopyridin-4-amine | CAS Registry Number: 7598-35-8
Synonyms: 2-Bromo-4-pyridinamine, 2-bromopyridin-4-ylamine, 654086_ALDRICH, NSC404690, CID346455, A2493G1, ST5166229, TL8005193, AC-907/30003013

Molecular Formula: C5H5BrN2Molecular Weight: 173.010600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GNTGEMWEXKBWBX-UHFFFAOYSA-N

• 5-Bromo-2-fluoropyridine
IUPAC Name: 5-bromo-2-fluoropyridine | CAS Registry Number: 766-11-0
Synonyms: 2-Fluoro-5-bromopyridine, 520438_ALDRICH, ZINC00403389, ST5408838, TL8005246

Molecular Formula: C5H3BrFNMolecular Weight: 175.986423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MYUQKYGWKHTRPG-UHFFFAOYSA-N

• 1-(4-Nitrophenyl)-3-phenyl-2-thiourea
IUPAC Name: 1-(4-nitrophenyl)-3-phenylthiourea | CAS Registry Number: 7669-49-0
Synonyms: 1-(4-nitrophenyl)-3-phenylthiourea, ST50410497, ZINC04244897, AC1MC26L, CTK2G7447, MolPort-000-157-778, N-(4-nitrophenyl)-N'-phenylthiourea, 1-(4-nitrophenyl)-3-phenyl-thiourea, AKOS003410071, AG-H-06216, MCULE-8234531674, KB-87138, Thiourea, N-(4-nitrophenyl)-N'-phenyl-, KB-102308, LS-153561, FT-0636552, A838800, [(4-nitrophenyl)amino](phenylamino)methane-1-thione, I09-2281

Molecular Formula: C13H11N3O2SMolecular Weight: 273.310340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NNWRRGBHDKYELI-UHFFFAOYSA-N

• 1-(4-Fluoro-2-nitrophenyl)pyrrolidine
IUPAC Name: 1-(4-fluoro-2-nitrophenyl)pyrrolidine | CAS Registry Number: 778-56-3
Synonyms: ZINC04244795, CID2737438, N-(4-Fluoro-2-nitro-phenyl)-pyrrolidine

Molecular Formula: C10H11FN2O2Molecular Weight: 210.204943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PSUGFUCCTASXGW-UHFFFAOYSA-N

• 5-Methyl-2'-deoxycytidine
IUPAC Name: 4-amino-1-[(2S,4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one | CAS Registry Number: 838-07-3
Synonyms: AIDS220180, 5-METHYL-2'-DESOXYCYTIDINE, AIDS-220180, ZINC00056702, 2(1H)-Pyrimidinone, 4-amino-1-(2-deoxy-b-L-erythro-pentofuranosyl)-5-methyl-

Molecular Formula: C10H15N3O4Molecular Weight: 241.243800 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: LUCHPKXVUGJYGU-CSMHCCOUSA-N

• 2-Fluoropyridine-3-boronic Acid
IUPAC Name: (2-fluoropyridin-3-yl)boronic acid | CAS Registry Number: 174669-73-9
Synonyms: 2-Fluoropyridine-3-boronic acid, BM568

Molecular Formula: C5H5BFNO2Molecular Weight: 140.908103 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YUHZIUAREWNXJT-UHFFFAOYSA-N

• 2-Fluoropyridine-4-boronic Acid
IUPAC Name: (2-fluoropyridin-4-yl)boronic acid | CAS Registry Number: 401815-98-3
Synonyms: 2-Fluoropyridine-4-boronic acid, F2370G1

Molecular Formula: C5H5BFNO2Molecular Weight: 140.908103 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WXGBZJJAGLSBPR-UHFFFAOYSA-N

• 2-Fluoropyridine-5-boronic Acid
IUPAC Name: (6-fluoropyridin-3-yl)boronic acid | CAS Registry Number: 351019-18-6
Synonyms: 639184_ALDRICH, 2-Fluoro-5-pyridylboronic acid, 2-Fluoropyridine-5-boronic acid, BM617, (6-fluoropyridin-3-yl)boronic acid, 20

Molecular Formula: C5H5BFNO2Molecular Weight: 140.908103 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: OJBYZWHAPXIJID-UHFFFAOYSA-N

• 2-Chloro-4-Methyl-5-Nitro Pyridine
IUPAC Name: 2-chloro-4-methyl-5-nitropyridine | CAS Registry Number: 23056-33-9
Synonyms: TPC-PY010, 290122_ALDRICH, NSC402978, 2-Chloro-4-methyl-5-nitropyridine, 2-Chloro-5-nitro-4-methylpyridine, 2-Chloro-4-methyl-5-nitro-pyridine, CID345364, ZINC01595322, TL806186, InChI=1/C6H5ClN2O2/c1-4-2-6(7)8-3-5(4)9(10)11/h2-3H,1H

Molecular Formula: C6H5ClN2O2Molecular Weight: 172.569100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: HWZUMEVIIGNXGM-UHFFFAOYSA-N

• 2-Chloro-5-nitropyrimidine
IUPAC Name: 2-chloro-5-nitropyrimidine | CAS Registry Number: 10320-42-0
Synonyms: Ambap4214, 2-Chloro-5-nitropyrimidin, Pyrimidine, 2-chloro-5-nitro-, NSC528724, CID82544, EINECS 233-703-8, TL8000144

Molecular Formula: C4H2ClN3O2Molecular Weight: 159.530580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OFCBNMYNAHUDGE-UHFFFAOYSA-N

• 3-Amino-6-bromopyridine
IUPAC Name: 6-bromopyridin-3-amine | CAS Registry Number: 13534-97-9
Synonyms: 6-bromopyridin-3-amine, 3-pyridinamine, 6-bromo-, TPC-PY088, Pyridine, 3-amino-6-bromo-, 552844_ALDRICH, ZINC01427060, CID642811, A163, TL8000826, A3636/0154273, InChI=1/C5H5BrN2/c6-5-2-1-4(7)3-8-5/h1-3H,7H

Molecular Formula: C5H5BrN2Molecular Weight: 173.010600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XTHKRYHULUJQHN-UHFFFAOYSA-N

• 3-Amino-2-fluoropyridine
IUPAC Name: 2-fluoropyridin-3-amine | CAS Registry Number: 1597-33-7
Synonyms: 2-fluoropyridin-3-amine, 2-fluoro-3-aminopyridine, 2-fluoro-3-pyridylamine, 2-fluoro-pyridin-3-ylamine, SBB069766, AG-E-09143, PubChem1259, AC1MC7DU, 3-Pyridinamine,2-fluoro-, SureCN998033, 3-Amino-2- fluoropyridine, SureCN2067017, Jsp003175, 2-FLUORO-3-PYRIDINAMINE, CTK4D0200, MolPort-001-778-552, 3-AMINO-2-FLUORO-PYRIDINE, 3-PYRIDINAMINE, 2-FLUORO-, ANW-74780, ZINC02506896

Molecular Formula: C5H5FN2Molecular Weight: 112.105003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: QVDACIZNNNFTBO-UHFFFAOYSA-N

• (S)-(-)-Alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid
IUPAC Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid | CAS Registry Number: 17257-71-5
Synonyms: Mosher's acid, MTPA, (+)-Mtpa, 156558_ALDRICH, 65371_FLUKA, EINECS 241-292-1, EINECS 243-829-5, NSC370475, SBB000723, ST5307071, TL80073733, alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, ()-alpha-Methoxy-alpha-trifluoromethylphenylacetic acid, (R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid, (+)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, (-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetic acid, Benzeneacetic acid, alpha-methoxy-alpha-(trifluoromethyl)-, (-)-.alpha.-Methoxy-.alpha.-trifluoromethylphenylacetic acid, (S)-(-)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetic acid, Benzeneacetic acid, .alpha.-methoxy-.alpha.-(trifluoromethyl)-, (R)-

Molecular Formula: C10H9F3O3Molecular Weight: 234.171870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: JJYKJUXBWFATTE-UHFFFAOYSA-N

• 5-Nitronicotinic acid
IUPAC Name: 5-nitropyridine-3-carboxylic acid | CAS Registry Number: 2047-49-6
Synonyms: 5-NITRONICOTINIC ACID, 5-nitropyridine-3-carboxylic Acid, 5-Nitronicotinicacid, 3-Carboxy-5-nitropyridine, 5-Nitro-3-pyridinecarboxylic acid, 3-Pyridinecarboxylic acid, 5-nitro-, SBB065283, AG-E-50104, 5-Nitro-nicotinic acid, ACMC-209fap, AC1LTT9U, SureCN940807, CTK1A1411, MolPort-000-005-078, 3-Pyridinecarboxylicacid, 5-nitro-, ANW-24095, AKOS005199247, AB17149, QC-6683, RP02545

Molecular Formula: C6H4N2O4Molecular Weight: 168.106960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: TZAGBVHIUUFVCJ-UHFFFAOYSA-N

• 4,6-Diacetylresorcinol
IUPAC Name: 1-(5-acetyl-2,4-dihydroxyphenyl)ethanone | CAS Registry Number: 2161-85-5
Synonyms: 391794_ALDRICH, 4,6-Diacetyl-1,3-benzenediol, EINECS 218-482-8, ZINC00157769, ST5331364, Ethanone, 1,1'-(4,6-dihydroxy-1,3-phenylene)bis-, 1,1'-(4,6-Dihydroxy-1,3-phenylene)bisethanone, 1,1'-(4,6-Dihydroxy-1,3-phenylene)bisethan-1-one, InChI=1/C10H10O4/c1-5(11)7-3-8(6(2)12)10(14)4-9(7)13/h3-4,13-14H,1-2H

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GEYCQLIOGQPPFM-UHFFFAOYSA-N

• 1-(N-Methylpiperidin-4-yl)piperazine
IUPAC Name: 1-(1-methylpiperidin-4-yl)piperazine | CAS Registry Number: 23995-88-2
Synonyms: 1-Methyl-4-piperazinopiperidine, 71277_FLUKA, 1-(1-Methyl-4-piperidinyl)piperazine, ALBB-005352, 1-(1-methylpiperidin-4-yl)piperazine, Piperazine, 1-(1-methyl-4-piperidyl)-, 1-(1-Methyl-piperidin-4-yl)-piperazine

Molecular Formula: C10H21N3Molecular Weight: 183.293840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OHUMKYGINIODOY-UHFFFAOYSA-N

• (1S,2S)-1,2-Diphenyl-1,2-ethanediamine
IUPAC Name: [(1S,2S)-2-azaniumyl-1,2-di(phenyl)ethyl]azanium | CAS Registry Number: 29841-69-8
Synonyms: ZINC00155133

Molecular Formula: C14H18N2+2Molecular Weight: 214.306120 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: PONXTPCRRASWKW-KBPBESRZSA-P

• (2-Benzimidazolylthio)acetic acid hydrazide
IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanyl)acetohydrazide | CAS Registry Number: 30065-27-1
Synonyms: Oprea1_175593, Oprea1_717482, ZINC00039853, CID676606, BAS 00631314, A0773/0036143, (1H-Benzoimidazol-2-ylsulfanyl)-acetic acid hydrazide, (1H-Benzoimidazol-2-ylsulfanyl)acetic acid, hydrazide

Molecular Formula: C9H10N4OSMolecular Weight: 222.266900 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: UIHKXOZJFOTOCE-UHFFFAOYSA-N

• 2-Amino-5-nitropyrimidine
IUPAC Name: 5-nitropyrimidin-2-amine | CAS Registry Number: 3073-77-6
Synonyms: 2-Pyrimidinamine, 5-nitro-, 5-Nitropyrimidin-2-amine, Ambap7333, A70836_ALDRICH, 2-amino-5-(nitro)pyrimidine, NSC37682, NSC48065, EINECS 221-348-1, NSC 37682, NSC 48065, SBB004166, ZINC03860187, AI3-50815, TL8002361, AB-323/25048283

Molecular Formula: C4H4N4O2Molecular Weight: 140.100160 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SSHFCFRJYJIJDV-UHFFFAOYSA-N

• 5-Methylnicotinic acid
IUPAC Name: 5-methylpyridine-3-carboxylic acid | CAS Registry Number: 3222-49-9
Synonyms: Nicotinic acid, 5-methyl-, NCIOpen2_001043, NSC82649, BTB 09653, TL8002449

Molecular Formula: C7H7NO2Molecular Weight: 137.135980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DJDHHXDFKSLEQY-UHFFFAOYSA-N

• 3-Bromo-5-methylpyridine
IUPAC Name: 3-bromo-5-methylpyridine | CAS Registry Number: 3430-16-8
Synonyms: 3-bromo-5-methylpyridine, 5-Bromo-3-picoline, 3-bromo-5-picoline, 5-bromo-3-methylpyridine, 3-brom-5-methylpyridin, 3-methyl-5-bromopyridine, ZINC00331876, zlchem 381, PubChem4036, AGN-PC-0DBESO, AC1LG9QR, ACMC-209i6c, SureCN315970, AC1Q25UZ, KSC497K7D, CTK3J7571, ZLC0227, MolPort-001-768-344, ACT06735, ANW-27826

Molecular Formula: C6H6BrNMolecular Weight: 172.022540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ADCLTLQMVAEBLB-UHFFFAOYSA-N

• 1-Amino-cis-cyclopentane-1,3-dicarboxylic acid
IUPAC Name: (1S,3S)-1-aminocyclopentane-1,3-dicarboxylic acid | CAS Registry Number: 39026-63-6
Synonyms: (1S,3S)-1-aminocyclopentane-1,3-dicarboxylic acid, cis-ACPD, 111900-31-3, 477331-06-9, Tocris-0186, Tocris-0187, Tocris-0284, AC1O7GRG, SureCN481144, 1,3-Cyclopentanedicarboxylicacid, 1-amino-, (1S,3S)-, (+/-)-1-AMINOCYCLOPENTANE-cis-1,3-DICARBOXYLIC ACID, CHEMBL29726, CHEBI:41310, CTK0H2865, YFYNOWXBIBKGHB-FFWSUHOLSA-, CHEBI:138940, AKOS006273106, AG-A-01473, NCGC00024487-01, NCGC00024488-01

Molecular Formula: C7H11NO4Molecular Weight: 173.166540 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: YFYNOWXBIBKGHB-FFWSUHOLSA-N

• 3-Fluoro-5-methylpyridine
IUPAC Name: 3-fluoro-5-methylpyridine | CAS Registry Number: 407-21-6
Synonyms: 3-fluoro-5-methylpyridine, 3-Fluoro-5-picoline, 5-Fluoro-3-picoline, 3-METHYL-5-FLUOROPYRIDINE, 5-FLUORO-3-METHYLPYRIDINE, PubChem10630, SureCN11980, ACMC-209jg9, AC1MC7I2, 3-Fluoro-5-methylpyridine,, CTK8B1648, MolPort-001-771-727, ANW-29479, ZINC02384097, AKOS005063647, AB13643, AF10135, AG-F-44609, AM62408, RP00524

Molecular Formula: C6H6FNMolecular Weight: 111.116943 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CKQXPRSCSFUGRC-UHFFFAOYSA-N

• 2-Bromo-5-fluoropyridine
IUPAC Name: 2-bromo-5-fluoropyridine | CAS Registry Number: 41404-58-4
Synonyms: Ambap6179, TPC-PY083, 595675_ALDRICH, ZINC02559898, CID2783171, B212, TL806442, AC-907/25004337

Molecular Formula: C5H3BrFNMolecular Weight: 175.986423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UODINHBLNPPDPD-UHFFFAOYSA-N

• 3-Amino-2-hydroxypyridine
IUPAC Name: 3-amino-1H-pyridin-2-one | CAS Registry Number: 59315-44-5
Synonyms: 3-aminopyridin-2-ol, 3-Amino-2-pyridinol, 33630-99-8, 2(1H)-Pyridinone, 3-amino-, 3-aminopyridin-2(1H)-one, 3-Amino-2-pyridone, 3-amino-1H-pyridin-2-one, 3-amino-pyridin-2-ol, NSC279497, 2-HYDROXY-3-AMINOPYRIDINE, ST041905, AE-641/00363028, PubChem1263, 3-Amino-2-pyridinone, ACMC-1AJGZ, 2-Pyridinol, 3-amino-, SureCN87697, 3-aminohydropyridin-2-one, SureCN105350, SureCN9235097

Molecular Formula: C5H6N2OMolecular Weight: 110.113940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VTSFNCCQCOEPKF-UHFFFAOYSA-N

• 1-(4-Benzyloxyphenyl)-2-thiourea
IUPAC Name: [4-(phenylmethoxy)phenyl]thiourea | CAS Registry Number: 65069-53-6
Synonyms: AIDS247061, AIDS-247061, ZINC02528135, Thiourea, N-[4-(phenylmethoxy)phenyl]-, T5342845

Molecular Formula: C14H14N2OSMolecular Weight: 258.338760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: TVUKNBBQSFMNAL-UHFFFAOYSA-N

• 1-(4-tert-Butyl-phenyl)-piperazine
IUPAC Name: 1-(4-tert-butylphenyl)piperazine | CAS Registry Number: 68104-61-0
Synonyms: Oprea1_499891, Oprea1_856823, EINECS 268-473-8, 1-(4-tert-Butylphenyl)piperazine, CID781722, ST5320005

Molecular Formula: C14H22N2Molecular Weight: 218.337880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ORDMNUOREWSOKN-UHFFFAOYSA-N


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