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Search results for: '2891580-45-1'
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2-chloro-5-methyl-4-nitropyridine
Cas Number: 97944-45-1Formula: C6H5ClN2O2Molecular weight: 172.57Synonyms: 2-Chloro-5-methyl-4-nitropyridine|97944-45-1|MFCD19690032|Pyridine, 2-chloro-5-methyl-4-nitro-|SCHEM...SMILES: CC1=CN=C(C=C1[N+](=O)[O-])ClInChIKey: PEGDFBBVKXPIME-UHFFFAOYSA-NInChI: InChI=1S/C6H5ClN2O2/c1-4-3-8-6(7)2-5(4)9(10)11/h2-3H,1H3
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N1-Methyl-4-Nitrobenzene-1-Sulfonamide
Cas Number: 6319-45-5Formula: C7H8N2O4SMolecular weight: 216.2Synonyms: N-Methyl-4-nitrobenzenesulfonamide|6319-45-5|CHEMBL34350|Benzenesulfonamide, N-methyl-4-nitro-|N-met...SMILES: CNS(=O)(=O )C1=CC=C(C=C1)[N+](=O)[O-]InChIKey: IHIJFQRUYCEKCZ-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2O4S/c1-8-14(12,13)7-4-2-6(3-5-7)9(10)11/h2-5,8H,1H3
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4-amino-1-methylpiperidin-2-one hydrochloride
Cas Number: 1373223-45-0Formula: C6H13ClN2OMolecular weight: 164.63Synonyms: 4-Amino-1-methylpiperidin-2-one hydrochloride|1373223-45-0|1-Methyl-4-amino-2-piperidinone hydrochlo...SMILES: CN1CCC(CC1=O)N.ClInChIKey: YWKDSIRYNGGSHR-UHFFFAOYSA-NInChI: InChI=1S/C6H12N2O.ClH/c1-8-3-2-5(7)4-6(8)9;/h5H,2-4,7H2,1H3;1H
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Methyl 1-cbz-5-hydroxypiperidine-3-carboxylate
Cas Number: 1095010-45-9Formula: C15H19NO5Molecular weight: 293.319Synonyms: 1095010-45-9|METHYL 1-CBZ-5-HYDROXYPIPERIDINE-3-CARBOXYLATE|1-Benzyl 3-methyl 5-hydroxypiperidine-1,...SMILES: COC(=O)C1CC(CN(C1)C(=O)OCC2=CC=CC=C2)OInChIKey: LOGZOMIRLZGSSW-UHFFFAOYSA-NInChI: InChI=1S/C15H19NO5/c1-20-14(18)12-7-13(17)9-16(8-12)15(19)21-10-11-5-3-2-4-6-11/h2-6,12-13,17H,7-10H2,1H3
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(3-Phenyloxetan-3-yl)methanamine
Cas Number: 497239-45-9Formula: C10H13NOMolecular weight: 163.22Synonyms: (3-phenyloxetan-3-yl)methanamine|497239-45-9|3-Oxetanemethanamine, 3-phenyl-|MFCD18251065|3-OXETANE...SMILES: C1C(CO1)(CN)C2=CC=CC=C2InChIKey: TVBXQZRCYHWTSD-UHFFFAOYSA-NInChI: InChI=1S/C10H13NO/c11-6-10(7-12-8-10)9-4-2-1-3-5-9/h1-5H,6-8,11H2
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5,6-dichloropyridin-2-amine
Cas Number: 1192814-45-1 EC Number: 826-667-5Formula: C5H4Cl2N2Molecular weight: 163Synonyms: 2-Amino-5,6-dichloropyridine | AS-43642 | SB54092 | 5,6-Dichloro-pyridin-2-ylamine | MFCD17012012 | ...SMILES: C1=CC(=NC(=C1Cl)Cl)NInChIKey: LULBBYYBHKFKBH-UHFFFAOYSA-NInChI: InChI=1S/C5H4Cl2N2/c6-3-1-2-4(8)9-5(3)7/h1-2H,(H2,8,9)
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1-Ethylbenzimidazolinone, Activator of K Ca2.1;Activator of K Ca2.2;Activator of K Ca2.3;Activator of K Ca3.1
Cas Number: 10045-45-1Formula: C9H10N2OMolecular weight: 162.2Synonyms: 10045-45-1|1-EBIO|1-Ethyl-2-benzimidazolinone|1-Ethylbenzimidazolinone|1-ethyl-1H-benzo[d]imidazol-2...SMILES: CCN1C2=CC=CC=C2NC1=OInChIKey: CXUCKELNYMZTRT-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2O/c1-2-11-8-6-4-3-5-7(8)10-9(11)12/h3-6H,2H2,1H3,(H,10,12)
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5-bromo-1-methyl-3-nitro-1,2-dihydropyridin-2-one
Cas Number: 153888-45-0Formula: C6H5BrN2O3Molecular weight: 233.02Synonyms: 5-Bromo-1-methyl-3-nitropyridin-2(1H)-one|153888-45-0|5-bromo-1-methyl-3-nitro-1,2-dihydropyridin-2-...SMILES: CN1C=C(C=C(C1=O)[N+](=O)[O-])BrInChIKey: VFWZQRFZMKHGOY-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrN2O3/c1-8-3-4(7)2-5(6(8)10)9(11)12/h2-3H,1H3
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tert-butyl cis-3-(aminomethyl)-4-hydroxypyrrolidine-1-carboxylate
Synonyms: cis-1-Boc-3-hydroxy-4-aminomethylpyrrolidine|872714-78-8|872717-45-8|TERT-BUTYL (3S,4S)-3-(AMINOMETH...SMILES: CC(C)(C)OC(=O)N1CC(C(C1)O)CNInChIKey: AHJZEZIYOBGVSK-JGVFFNPUSA-NInChI: InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-7(4-11)8(13)6-12/h7-8,13H,4-6,11H2,1-3H3/t7-,8+/m0/s1
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Pentaerythritol tris(3-(1-aziridinyl)propionate)
Cas Number: 57116-45-7Formula: C20H33N3O7Molecular weight: 427.5Synonyms: Pentaerythritoltris(3-(1-aziridinyl)propionate) | CS-0158335 | Tox21_302250 | Xama 7 | BCP18152 | EI...SMILES: C1CN1CCC(=O)OCC(CO)(COC(=O)CCN2CC2)COC(=O)CCN3CC3InChIKey: KAPCRJOPWXUMSQ-UHFFFAOYSA-NInChI: InChI=1S/C20H33N3O7/c24-13-20(14-28-17(25)1-4-21-7-8-21,15-29-18(26)2-5-22-9-10-22)16-30-19(27)3-6-23-11-12-23/h24H,1-16H2
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1,6-Dihydro-1-methyl-6-oxo-3-pyridinecarboxylic acid
Cas Number: 3719-45-7Formula: C7H7NO3Molecular weight: 153.14Synonyms: 1-methyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid|3719-45-7|1-methyl-6-oxopyridine-3-carboxylic a...SMILES: CN1C=C(C=CC1=O)C(=O)OInChIKey: RGZCKPXTNJAWMR-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO3/c1-8-4-5(7(10)11)2-3-6(8)9/h2-4H,1H3,(H,10,11)
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2-Amino-6-ethoxybenzothiazole
Cas Number: 94-45-1Formula: C9H10N2OSMolecular weight: 194.25Synonyms: UNII-D621HZ191D | (6-ETHOXYBENZOTHIAZOL-2-YL)AMINE | 2-Benzothiazolamine, 6-ethoxy- | CAS-94-45-1 | ...SMILES: CCOC1=CC2=C(C=C1)N=C(S2)NInChIKey: KOYJWFGMEBETBU-UHFFFAOYSA-NInChI: InChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11)
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4-(tert-Butyldimethylsilyloxy)cyclohexanone
Cas Number: 55145-45-4Formula: C12H24O2SiMolecular weight: 228.4Synonyms: 55145-45-4|4-(tert-Butyldimethylsilyloxy)cyclohexanone|4-((tert-Butyldimethylsilyl)oxy)cyclohexanone...SMILES: CC(C)(C)[Si](C)(C)OC1CCC(=O)CC1InChIKey: HXKBGMNGSYGPRB-UHFFFAOYSA-NInChI: InChI=1S/C12H24O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h11H,6-9H2,1-5H3
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ETHYL 1-(4-BROMOPHENYL)-5-METHYL-1H-PYRAZOLE-4-CARBOXYLATE
Cas Number: 187998-45-4Formula: C13H13BrN2O2Molecular weight: 309.165Synonyms: ethyl 1-(4-bromophenyl)-5-methyl-1H-pyrazole-4-carboxylate|187998-45-4|ethyl 1-(4-bromophenyl)-5-met...SMILES: CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)Br)CInChIKey: LMHJVIOBYOFILY-UHFFFAOYSA-NInChI: InChI=1S/C13H13BrN2O2/c1-3-18-13(17)12-8-15-16(9(12)2)11-6-4-10(14)5-7-11/h4-8H,3H2,1-2H3
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10-Undecenal
Formula: C11H20OMolecular weight: 168.28Synonyms: CAS-112-45-8 | FEMA No. 3095 | EINECS 203-973-1 | NCGC00255582-01 | n-UNDECYLENIC ALDEHYDE (10-1) | ...SMILES: C=CCCCCCCCCC=OInChIKey: OFHHDSQXFXLTKC-UHFFFAOYSA-NInChI: InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,11H,1,3-10H2
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Tomatine from Tomato
Cas Number: 17406-45-0 EC Number: 241-429-5Formula: C50H83NO21Molecular weight: 1034.2Synonyms: Tomatine|Lycopersicin|alpha-Tomatine|A''-Tomatidine|17406-45-0|Tomatin|CHEBI:9630|Tomatidine, glycos...SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)C)C)C)NC1InChIKey: REJLGAUYTKNVJM-SGXCCWNXSA-NInChI: See more
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1-Indanone-5-carboxylic acid
Cas Number: 3470-45-9Formula: C10H8O3Molecular weight: 176.17Synonyms: 3470-45-9|1-INDANONE-5-CARBOXYLIC ACID|1-Oxoindan-5-carboxylic acid|1-Oxoindane-5-carboxylic Acid|1-...SMILES: C1CC(=O)C2=C1C=C(C=C2)C(=O)OInChIKey: SLLCLJRVOCBDTC-UHFFFAOYSA-NInChI: InChI=1S/C10H8O3/c11-9-4-2-6-5-7(10(12)13)1-3-8(6)9/h1,3,5H,2,4H2,(H,12,13)
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1H-1,3-Benzodiazol-5-yl(phenyl)methanamine
Cas Number: 929974-45-8Formula: C14H13N3Molecular weight: 223.3Synonyms: 929974-45-8|(1H-Benzo[d]imidazol-5-yl)(phenyl)methanamine|1H-1,3-Benzodiazol-5-yl(phenyl)methanamine...SMILES: C1=CC=C(C=C1)C(C2=CC3=C(C=C2)N=CN3)NInChIKey: CSGGYTQFKDJKFI-UHFFFAOYSA-NInChI: InChI=1S/C14H13N3/c15-14(10-4-2-1-3-5-10)11-6-7-12-13(8-11)17-9-16-12/h1-9,14H,15H2,(H,16,17)
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Ethyl 4-((2-amino-4-chlorophenyl)amino)piperidine-1-carboxylate
Cas Number: 53786-45-1Formula: C14H20ClN3O2Molecular weight: 297.78Synonyms: 53786-45-1|Ethyl 4-((2-amino-4-chlorophenyl)amino)piperidine-1-carboxylate|ethyl 4-(2-amino-4-chloro...SMILES: CCOC(=O)N1CCC(CC1)NC2=C(C=C(C=C2)Cl)NInChIKey: PPCPQDDCMQRJLS-UHFFFAOYSA-NInChI: InChI=1S/C14H20ClN3O2/c1-2-20-14(19)18-7-5-11(6-8-18)17-13-4-3-10(15)9-12(13)16/h3-4,9,11,17H,2,5-8,16H2,1H3
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Carmofur
Cas Number: 61422-45-5Formula: C11H16FN3O3Molecular weight: 257.27Synonyms: carmofur|61422-45-5|HCFU|Mifurol|1-Hexylcarbamoyl-5-fluorouracil|5-fluoro-N-hexyl-2,4-dioxo-3,4-dihy...SMILES: CCCCCCNC(=O)N1C=C(C(=O)NC1=O)FInChIKey: AOCCBINRVIKJHY-UHFFFAOYSA-NInChI: InChI=1S/C11H16FN3O3/c1-2-3-4-5-6-13-10(17)15-7-8(12)9(16)14-11(15)18/h7H,2-6H2,1H3,(H,13,17)(H,14,16,18)
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2-Chloro-6-(5-trifluoromethylpyrazol-1-yl)pyridine
Cas Number: 1150164-45-6Formula: C9H5ClF3N3Molecular weight: 247.6Synonyms: 1150164-45-6|2-Chloro-6-(5-(trifluoromethyl)-1H-pyrazol-1-yl)pyridine|2-CHLORO-6-(5-TRIFLUOROMETHYLP...SMILES: C1=CC(=NC(=C1)Cl)N2C(=CC=N2)C(F)(F)FInChIKey: OCZTUNUDTAJGPS-UHFFFAOYSA-NInChI: InChI=1S/C9H5ClF3N3/c10-7-2-1-3-8(15-7)16-6(4-5-14-16)9(11,12)13/h1-5H
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Primaquine bisphosphate
Cas Number: 63-45-6Formula: C15H21N3O.2H3PO4Molecular weight: 455.34Synonyms: primaquine diphosphate|63-45-6|PRIMAQUINE PHOSPHATE|Primaquine bisphosphate|Primaquine (Diphosphate)...SMILES: CC(CCCN)NC1=C2C(=CC(=C1)OC)C=CC=N2.OP(=O)(O)O.OP(=O)(O)OInChIKey: GJOHLWZHWQUKAU-UHFFFAOYSA-NInChI: InChI=1S/C15H21N3O.2H3O4P/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14;2*1-5(2,3)4/h4,6,8-11,18H,3,5,7,16H2,1-2H3;2*(H3,1,2,3,4)
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Ractopamine hydrochloride
Cas Number: 90274-24-1Formula: C18H23NO3.HClMolecular weight: 337.84Synonyms: Ractopamine hydrochloride|90274-24-1|Ractopamine HCl|El737|Optaflexx 45|4-(1-Hydroxy-2-((4-(4-hydrox...SMILES: CC(CCC1=CC=C(C=C1)O)NCC(C2=CC=C(C=C2)O)O.ClInChIKey: JHGSLSLUFMZUMK-UHFFFAOYSA-NInChI: InChI=1S/C18H23NO3.ClH/c1-13(2-3-14-4-8-16(20)9-5-14)19-12-18(22)15-6-10-17(21)11-7-15;/h4-11,13,18-22H,2-3,12H2,1H3;1H
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Diisopropyl phthalate
Formula: C14H18O4Molecular weight: 250.29Synonyms: DIISOPROPYL PHTHALATE|605-45-8|Phthalic acid, diisopropyl ester|DIISOPROPYLPHTHALATE|di-i-propyl pht...SMILES: CC(C)OC(=O)C1=CC=CC=C1C(=O)OC(C)CInChIKey: QWDBCIAVABMJPP-UHFFFAOYSA-NInChI: InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3
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