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Search results for: '17819-91-9'
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(1H-Benzo[d]imidazol-2-yl)methanamine dihydrochloride
Cas Number: 5993-91-9Formula: C8H11Cl2N3Molecular weight: 220.1Synonyms: 5993-91-9|(1H-benzo[d]imidazol-2-yl)methanamine dihydrochloride|2-(AMINOMETHYL)BENZIMIDAZOLE DIHYDRO...SMILES: C1=CC=C2C(=C1)NC(=N2)CN.Cl.ClInChIKey: HAEYZZSSSUIZAN-UHFFFAOYSA-NInChI: InChI=1S/C8H9N3.2ClH/c9-5-8-10-6-3-1-2-4-7(6)11-8;;/h1-4H,5,9H2,(H,10,11);2*1H
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2-Methylnaphthalene
Formula: C11H10Molecular weight: 142.2Synonyms: InChI=1/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H | CAS-91-57-6 | NCGC00258393-01 | 2-Methylnaph...SMILES: CC1=CC2=CC=CC=C2C=C1InChIKey: QIMMUPPBPVKWKM-UHFFFAOYSA-NInChI: InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3
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1-(5-chloro-2-fluoro-3-pyridyl)ethanone
Cas Number: 1256808-91-9Formula: C7H5NOFClMolecular weight: 173.57Synonyms: 1256808-91-9 | 1-(5-chloro-2-fluoro-3-pyridyl)ethanone | 1-(5-CHLORO-2-FLUOROPYRIDIN-3-YL)ETHANONE |...SMILES: CC(=O)C1=C(N=CC(=C1)Cl)FInChIKey: NFZFSFZGXKYXOX-UHFFFAOYSA-NInChI: InChI=1S/C7H5ClFNO/c1-4(11)6-2-5(8)3-10-7(6)9/h2-3H,1H3
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Fmoc-1,6-diaminohexane
Cas Number: 166410-37-3Formula: C21H27ClN2O2Molecular weight: 374.91Synonyms: Fmoc-1,6-diaminohexane hydrochloride|945923-91-1|166410-37-3|Fmoc-hmd HCl|(9H-Fluoren-9-yl)methyl (6...SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCCCCN.ClInChIKey: SKDQIWLYPJOUMY-UHFFFAOYSA-NInChI: InChI=1S/C21H26N2O2.ClH/c22-13-7-1-2-8-14-23-21(24)25-15-20-18-11-5-3-9-16(18)17-10-4-6-12-19(17)20;/h3-6,9-12,20H,1-2,7-8,13-15,22H2,(H,23,24);1H
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1,4-Dioxa-7-azaspiro[4.5]decane
Cas Number: 40369-91-3Formula: C7H13NO2Molecular weight: 143.18Synonyms: 1,4-Dioxa-7-azaspiro[4.5]decane|40369-91-3|1,4-DIOXA-7-AZA-SPIRO[4.5]DECANE|1,4-dioxa-9-azaspiro[4.5...SMILES: C1CC2(CNC1)OCCO2InChIKey: FZWPOVPBHOSLFN-UHFFFAOYSA-NInChI: InChI=1S/C7H13NO2/c1-2-7(6-8-3-1)9-4-5-10-7/h8H,1-6H2
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3-ACETYL-6,8-DICHLOROCOUMARIN
Cas Number: 2199-91-9Formula: C11H6Cl2O3Molecular weight: 257.075Synonyms: 3-acetyl-6,8-dichloro-2H-chromen-2-one|2199-91-9|3-acetyl-6,8-dichlorochromen-2-one|C11H6Cl2O3|3-ace...SMILES: CC(=O)C1=CC2=CC(=CC(=C2OC1=O)Cl)ClInChIKey: HCEPIRHGFPRDGG-UHFFFAOYSA-NInChI: InChI=1S/C11H6Cl2O3/c1-5(14)8-3-6-2-7(12)4-9(13)10(6)16-11(8)15/h2-4H,1H3
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1,3-Cyclohexadiene
Formula: C6H8Molecular weight: 80.13Synonyms: 1,3-CYCLOHEXADIENE|Cyclohexa-1,3-diene|592-57-4|CYCLOHEXADIENE|1,2-dihydrobenzene|JV5W0EG5BP|29797-0...SMILES: C1CC=CC=C1InChIKey: MGNZXYYWBUKAII-UHFFFAOYSA-NInChI: InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-4H,5-6H2
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4'-Fluoroisobutyrophenone
Cas Number: 26393-91-9Formula: C10H11FOMolecular weight: 166.2Synonyms: 1-(4-fluorophenyl)-2-methylpropan-1-one|26393-91-9|1-Propanone, 1-(4-fluorophenyl)-2-methyl-|4'-fluo...SMILES: CC(C)C(=O)C1=CC=C(C=C1)FInChIKey: MHUVRVXSYXJUPK-UHFFFAOYSA-NInChI: InChI=1S/C10H11FO/c1-7(2)10(12)8-3-5-9(11)6-4-8/h3-7H,1-2H3
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3-Amino-3-(3-trifluoromethylphenyl)propanoic acid
Cas Number: 143438-91-9Formula: C10H10F3NO2Molecular weight: 233.2Synonyms: 143438-91-9|3-amino-3-[3-(trifluoromethyl)phenyl]propanoic acid|3-Amino-3-[3-(trifluoromethyl)phenyl...SMILES: C1=CC(=CC(=C1)C(F)(F)F)C(CC(=O)O)NInChIKey: WZXBASRNQXYUIP-UHFFFAOYSA-NInChI: InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-2-6(4-7)8(14)5-9(15)16/h1-4,8H,5,14H2,(H,15,16)
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6-Bromo-3-hydroxyisoquinoline
Cas Number: 1031927-91-9Formula: C9H6BrNOMolecular weight: 224.1Synonyms: 6-Bromo-3-hydroxyisoquinoline|1031927-91-9|6-bromoisoquinolin-3-ol|6-Bromoisoquinolin-3(2H)-one|6-BR...SMILES: C1=CC2=CNC(=O)C=C2C=C1BrInChIKey: MZXOHGOCNRWAPY-UHFFFAOYSA-NInChI: InChI=1S/C9H6BrNO/c10-8-2-1-6-5-11-9(12)4-7(6)3-8/h1-5H,(H,11,12)
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1H-Indole-7-carboxylic acid,2,3-dihydro-,methyl ester
Cas Number: 112106-91-9Formula: C10H11NO2Molecular weight: 177.2Synonyms: Methyl indoline-7-carboxylate|112106-91-9|1h-indole-7-carboxylic acid,2,3-dihydro-,methyl ester|METH...SMILES: COC(=O)C1=CC=CC2=C1NCC2InChIKey: IMJZMELPOAMWJA-UHFFFAOYSA-NInChI: InChI=1S/C10H11NO2/c1-13-10(12)8-4-2-3-7-5-6-11-9(7)8/h2-4,11H,5-6H2,1H3
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2-Pyridin-3-yl-quinoline-4-carboxylic acid
Cas Number: 7482-91-9Formula: C15H10N2O2Molecular weight: 250.3Synonyms: 7482-91-9|2-(pyridin-3-yl)quinoline-4-carboxylic acid|2-Pyridin-3-yl-quinoline-4-carboxylic acid|2-p...SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)OInChIKey: XQNXXNNXRWYNAS-UHFFFAOYSA-NInChI: InChI=1S/C15H10N2O2/c18-15(19)12-8-14(10-4-3-7-16-9-10)17-13-6-2-1-5-11(12)13/h1-9H,(H,18,19)
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Methyl 2,4-dioxo-4-(pyridin-4-yl)butanoate
Cas Number: 374063-91-9Formula: C10H9NO4Molecular weight: 207.18Synonyms: 374063-91-9|methyl 2,4-dioxo-4-(pyridin-4-yl)butanoate|methyl 2,4-dioxo-4-pyridin-4-ylbutanoate|MFCD...SMILES: COC(=O)C(=O)CC(=O)C1=CC=NC=C1InChIKey: WOCFUTQLECHXPN-UHFFFAOYSA-NInChI: InChI=1S/C10H9NO4/c1-15-10(14)9(13)6-8(12)7-2-4-11-5-3-7/h2-5H,6H2,1H3
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TCPOBOP, Agonist of Constitutive androstane receptor
Cas Number: 76150-91-9Formula: C16H8Cl4N2O2Molecular weight: 402.06Synonyms: tcpobop|76150-91-9|1,4-Bis[2-(3,5-dichloropyridyloxy)]benzene|1,4-bis((3,5-dichloropyridin-2-yl)oxy)...SMILES: C1=CC(=CC=C1OC2=C(C=C(C=N2)Cl)Cl)OC3=C(C=C(C=N3)Cl)ClInChIKey: BAFKRPOFIYPKBQ-UHFFFAOYSA-NInChI: InChI=1S/C16H8Cl4N2O2/c17-9-5-13(19)15(21-7-9)23-11-1-2-12(4-3-11)24-16-14(20)6-10(18)8-22-16/h1-8H
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ambroxol
Cas Number: 18683-91-5Formula: C13H18Br2N2OMolecular weight: 378.1Synonyms: ambroxol|18683-91-5|107814-37-9|rac-cis-Ambroxol|36557-04-7|Ambroxol Base|4-((2-amino-3,5-dibromoben...SMILES: C1CC(CCC1NCC2=C(C(=CC(=C2)Br)Br)N)OInChIKey: JBDGDEWWOUBZPM-UHFFFAOYSA-NInChI: InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2
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methyl (2S)-2-amino-3-[(3S)-2-oxopiperidin-3-yl]propanoate hydrochloride
Cas Number: 2148975-91-9Formula: C9H16N2O3·2[HCl]Molecular weight: 273.16Synonyms: 2148975-91-9 | Methyl (2S)-2-amino-3-[(3S)-2-oxopiperidin-3-yl]propanoate hydrochloride | methyl (2S...SMILES: COC(=O)C(CC1CCCNC1=O)N.ClInChIKey: GCYWVOGKOSQSSZ-LEUCUCNGSA-NInChI: InChI=1S/C9H16N2O3.ClH/c1-14-9(13)7(10)5-6-3-2-4-11-8(6)12;/h6-7H,2-5,10H2,1H3,(H,11,12);1H/t6-,7-;/m0./s1
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1-Benzyl-3,3-dimethylpiperidin-4-one
Cas Number: 173186-91-9Formula: C14H19NOMolecular weight: 217.31Synonyms: 1-benzyl-3,3-dimethylpiperidin-4-one|173186-91-9|1-benzyl-3,3-dimethyl-piperidin-4-one|4-Piperidinon...SMILES: CC1(CN(CCC1=O)CC2=CC=CC=C2)CInChIKey: YKQMBPQMCWGNDY-UHFFFAOYSA-NInChI: InChI=1S/C14H19NO/c1-14(2)11-15(9-8-13(14)16)10-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3
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PU-H71
Cas Number: 873436-91-0Formula: C18H21IN6O2SMolecular weight: 512.37Synonyms: DivK1c_006639 | Oprea1_485666 | STR09510 | UNII-06IVK87M04 | PU-H71, d6 | HMS3653N04 | J-690375 | SB...SMILES: CC(C)NCCCN1C2=NC=NC(=C2N=C1SC3=C(C=C4C(=C3)OCO4)I)NInChIKey: SUPVGFZUWFMATN-UHFFFAOYSA-NInChI: InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)
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2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)-9,9-dihexyl-9H-9-dibenzosilole
Cas Number: 852138-91-1Formula: C36H56B2O4SiSynonyms: 852138-91-1|9,9-Dihexyl-9H-9-silafluorene-2,7-bis(boronic acid pinacol esteR)|2-[5,5-dihexyl-3-(4,4,...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C([Si]3(CCCCCC)CCCCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)CInChIKey: LROKIACOFVFLQY-UHFFFAOYSA-NInChI: InChI=1S/C36H56B2O4Si/c1-11-13-15-17-23-43(24-18-16-14-12-2)31-25-27(37-39-33(3,4)34(5,6)40-37)19-21-29(31)30-22-20-28(26-32(30)43)38-41-35(7,8)36(9,10)42-38/h19-22,25-26H,11-18,23-24H2,1-10H3
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Aloperine
Cas Number: 56293-29-9(Water)Formula: C15H24N2Molecular weight: 232.36Synonyms: Aloperine|56293-29-9|463944-91-4|(6r,6ar,13r,13as)-1,3,4,6,6a,7,8,9,10,12,13,13a-dodecahydro-2h-6,13...SMILES: C1CCN2CC3CC(C2C1)C=C4C3NCCC4InChIKey: SKOLRLSBMUGVOY-GBJTYRQASA-NInChI: InChI=1S/C15H24N2/c1-2-7-17-10-13-9-12(14(17)5-1)8-11-4-3-6-16-15(11)13/h8,12-16H,1-7,9-10H2/t12-,13+,14+,15+/m0/s1
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2-chloro-3,5-dinitrobenzoic Acid
Cas Number: 2497-91-8Formula: C7H3ClN2O6Molecular weight: 246.56Synonyms: 2-Chloro-3,5-dinitrobenzoic acid|2497-91-8|BENZOIC ACID, 2-CHLORO-3,5-DINITRO-|2-Carboxy-4,6-dinitro...SMILES: C1=C(C=C(C(=C1C(=O)O)Cl)[N+](=O)[O-])[N+](=O)[O-]InChIKey: ADTKEYLCJYYHHH-UHFFFAOYSA-NInChI: InChI=1S/C7H3ClN2O6/c8-6-4(7(11)12)1-3(9(13)14)2-5(6)10(15)16/h1-2H,(H,11,12)
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tert-butyl N-[(3R,4S)-4-fluoropyrrolidin-3-yl]carbamate
Cas Number: 1033718-91-0Formula: C9H17N2O2FMolecular weight: 204.24Synonyms: 1033718-91-0 | 169750-42-9 | cis-(3-Boc-amino)-4-fluoropyrrolidine | tert-Butyl ((3R,4S)-4-fluoropyr...SMILES: CC(C)(C)OC(=O)NC1CNCC1FInChIKey: BZSDDSIFAGBZLT-NKWVEPMBSA-NInChI: InChI=1S/C9H17FN2O2/c1-9(2,3)14-8(13)12-7-5-11-4-6(7)10/h6-7,11H,4-5H2,1-3H3,(H,12,13)/t6-,7+/m0/s1
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Crotonic Acid Butyl Ester
Cas Number: 7299-91-4Formula: C8H14O2Molecular weight: 142.2Synonyms: BUTYL CROTONATE|7299-91-4|2-Butenoic acid, butyl ester|butyl (E)-but-2-enoate|Butyl 2-butenoate|Crot...SMILES: CCCCOC(=O)C=CCInChIKey: GWCTUKHUBWMAMI-GQCTYLIASA-NInChI: InChI=1S/C8H14O2/c1-3-5-7-10-8(9)6-4-2/h4,6H,3,5,7H2,1-2H3/b6-4+
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