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Search results for: '1000572-63-3'
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1-benzyl-3-hydroxy-piperidine-4-carbonitrile
Cas Number: 1782225-63-1 EC Number: 827-250-0Formula: C13H16N2OMolecular weight: 216.28Synonyms: PS-16092 | 1013333-20-4 | 1782225-63-1 | F85940 | SCHEMBL21806054 | 1-benzyl-3-hydroxy-piperidine-4-...SMILES: C1CN(CC(C1C#N)O)CC2=CC=CC=C2InChIKey: XZYDMOVDIBVPOL-UHFFFAOYSA-NInChI: InChI=1S/C13H16N2O/c14-8-12-6-7-15(10-13(12)16)9-11-4-2-1-3-5-11/h1-5,12-13,16H,6-7,9-10H2
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5-Bromo-2-butoxy-3-methylpyridine
Cas Number: 1261895-63-9Formula: C10H14BrNOMolecular weight: 244.1Synonyms: 5-BROMO-2-BUTOXY-3-METHYLPYRIDINE|1261895-63-9|DTXSID60682467|MFCD18311905|AKOS015834250|Pyridine, 5...SMILES: CCCCOC1=NC=C(C=C1C)BrInChIKey: WEXJJRNSIABFEN-UHFFFAOYSA-NInChI: InChI=1S/C10H14BrNO/c1-3-4-5-13-10-8(2)6-9(11)7-12-10/h6-7H,3-5H2,1-2H3
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1-Benzyl-3-phenoxypiperidine
Cas Number: 136421-63-1Formula: C18H21NOMolecular weight: 267.37Synonyms: 1-BENZYL-3-PHENOXYPIPERIDINE|136421-63-1|Piperidine, 3-phenoxy-1-(phenylmethyl)-|1-Benzyl-3-phenoxy-...SMILES: C1CC(CN(C1)CC2=CC=CC=C2)OC3=CC=CC=C3InChIKey: NKJBWZQGCAPMGQ-UHFFFAOYSA-NInChI: InChI=1S/C18H21NO/c1-3-8-16(9-4-1)14-19-13-7-12-18(15-19)20-17-10-5-2-6-11-17/h1-6,8-11,18H,7,12-15H2
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3-iodo-1-methyl-indazole-5-carbonitrile
Cas Number: 1426423-63-3Formula: C9H6N3IMolecular weight: 283.07Synonyms: 3-iodo-1-methyl-1H-indazole-5-carbonitrile | 1426423-63-3 | 3-iodo-1-methyl-indazole-5-carbonitrile ...SMILES: CN1C2=C(C=C(C=C2)C#N)C(=N1)IInChIKey: ONXPKVVUCXTMNG-UHFFFAOYSA-NInChI: InChI=1S/C9H6IN3/c1-13-8-3-2-6(5-11)4-7(8)9(10)12-13/h2-4H,1H3
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(3S)-4,4-difluoropyrrolidin-3-ol;hydrochloride
Cas Number: 2344751-63-7Synonyms: 2344751-63-7 | (3S)-4,4-difluoropyrrolidin-3-ol | hydrochloride | (3S)-4,4-Difluoropyrrolidin-3-ol H...SMILES: C1C(C(CN1)(F)F)O.ClInChIKey: NLERLCGBOKVMAG-DFWYDOINSA-NInChI: InChI=1S/C4H7F2NO.ClH/c5-4(6)2-7-1-3(4)8;/h3,7-8H,1-2H2;1H/t3-;/m0./s1
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1-ethylpyrrolidin-3-amine dihydrochloride
Cas Number: 1337882-63-9Formula: C6H16Cl2N2Molecular weight: 187.11Synonyms: 1-ethylpyrrolidin-3-amine dihydrochloride|1337882-63-9|1-Ethylpyrrolidin-3-amine 2HCl|1-ethylpyrroli...SMILES: CCN1CCC(C1)N.Cl.ClInChIKey: MEPWCWGVVOIHJR-UHFFFAOYSA-NInChI: InChI=1S/C6H14N2.2ClH/c1-2-8-4-3-6(7)5-8;;/h6H,2-5,7H2,1H3;2*1H
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3-(3,4-Dihydroxyphenyl)-DL-alanine
Cas Number: 63-84-3Formula: C9H11NO4Molecular weight: 197.19Synonyms: DL-DOPA|63-84-3|3,4-Dihydroxy-DL-phenylalanine|2-Amino-3-(3,4-dihydroxyphenyl)propanoic acid|dihydro...SMILES: C1=CC(=C(C=C1CC(C(=O)O)N)O)OInChIKey: WTDRDQBEARUVNC-UHFFFAOYSA-NInChI: InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)
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ethyl 4-hydroxy-6-oxo-1H-pyridazine-3-carboxylate
Cas Number: 1352925-63-3 EC Number: 814-463-9Formula: C7H8N2O4Molecular weight: 184.15Synonyms: Ethyl4,6-dihydroxypyridazine-3-carboxylate | SY108710 | SCHEMBL24761791 | SCHEMBL4338135 | 1352925-6...SMILES: CCOC(=O)C1=NNC(=O)C=C1OInChIKey: QHSUCVJSGHLDIA-UHFFFAOYSA-NInChI: InChI=1S/C7H8N2O4/c1-2-13-7(12)6-4(10)3-5(11)8-9-6/h3H,2H2,1H3,(H2,8,10,11)
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3-Bromomethyl-benzoic acid tert-butyl ester
Cas Number: 126062-63-3Formula: C12H15BrO2Molecular weight: 271.15Synonyms: tert-butyl 3-(bromomethyl)benzoate|126062-63-3|3-Bromomethyl-benzoic Acid Tert-Butyl Ester|Benzoic a...SMILES: CC(C)(C)OC(=O)C1=CC=CC(=C1)CBrInChIKey: FWVVBSNKXPFYMT-UHFFFAOYSA-NInChI: InChI=1S/C12H15BrO2/c1-12(2,3)15-11(14)10-6-4-5-9(7-10)8-13/h4-7H,8H2,1-3H3
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3-Iodo-2-methoxy-5-methylpyridine
Cas Number: 1203499-63-1Formula: C7H8INOMolecular weight: 249Synonyms: 3-Iodo-2-methoxy-5-methylpyridine|1203499-63-1|SCHEMBL12903271|DTXSID00673571|MFCD13176638|AKOS01585...SMILES: CC1=CC(=C(N=C1)OC)IInChIKey: KPEWLACJKQHYTH-UHFFFAOYSA-NInChI: InChI=1S/C7H8INO/c1-5-3-6(8)7(10-2)9-4-5/h3-4H,1-2H3
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Methyl 3-Bromopyruvate
Cas Number: 7425-63-0Formula: C4H5BrO3Molecular weight: 180.99Synonyms: Methyl bromopyruvate|7425-63-0|methyl 3-bromo-2-oxopropanoate|Methyl 3-bromopyruvate|MethylBromopyru...SMILES: COC(=O)C(=O)CBrInChIKey: MQONVZMIFQQQHA-UHFFFAOYSA-NInChI: InChI=1S/C4H5BrO3/c1-8-4(7)3(6)2-5/h2H2,1H3
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ethyl 6-bromo-4-fluoro-pyrazolo[1,5-a]pyridine-3-carboxylate
Cas Number: 2177263-63-5Formula: C10H8N2O2FBrMolecular weight: 287.08Synonyms: ethyl 6-bromo-4-fluoropyrazolo[1,5-a]pyridine-3-carboxylate | 2177263-63-5 | MFCD31652657 | W16542 |...SMILES: CCOC(=O)C1=C2C(=CC(=CN2N=C1)Br)FInChIKey: FNTMKBPXHVYVSY-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrFN2O2/c1-2-16-10(15)7-4-13-14-5-6(11)3-8(12)9(7)14/h3-5H,2H2,1H3
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[3-(methylaminomethyl)oxetan-3-yl]methanol
Cas Number: 152401-63-3Formula: C6H13NO2Molecular weight: 131.17Synonyms: [3-(methylaminomethyl)oxetan-3-yl]methanol | 152401-63-3 | (3-((Methylamino)methyl)oxetan-3-yl)metha...SMILES: CNCC1(COC1)COInChIKey: WCNYKOBXERQLEK-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO2/c1-7-2-6(3-8)4-9-5-6/h7-8H,2-5H2,1H3
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2-(3-Bromo-4-fluorophenyl)acetonitrile
Cas Number: 501420-63-9Formula: C8H5BrFNMolecular weight: 214Synonyms: 2-(3-bromo-4-fluorophenyl)acetonitrile|501420-63-9|3-Bromo-4-fluorophenylacetonitrile|(3-Bromo-4-flu...SMILES: C1=CC(=C(C=C1CC#N)Br)FInChIKey: ORKCKZRBHXMWBO-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrFN/c9-7-5-6(3-4-11)1-2-8(7)10/h1-2,5H,3H2
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2-(methoxymethyl)azetidine hydrochloride
Cas Number: 1803592-63-3 EC Number: 828-460-5Formula: C5H12ClNOMolecular weight: 137.61Synonyms: EN300-222533 | SCHEMBL12487061 | 2-(methoxymethyl)azetidine;hydrochloride | F86025 | PS-17377 | 2-(m...SMILES: COCC1CCN1.ClInChIKey: WKUUAQJWHUDNSP-UHFFFAOYSA-NInChI: InChI=1S/C5H11NO.ClH/c1-7-4-5-2-3-6-5;/h5-6H,2-4H2,1H3;1H
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2-Bromo-6-fluoro-3-methylphenol
Cas Number: 1226808-63-4Formula: C7H6BrFOMolecular weight: 205Synonyms: 2-BROMO-6-FLUORO-3-METHYLPHENOL|1226808-63-4|2-Bromo-4-fluoro-3-hydroxytolulene|Phenol, 2-bromo-6-fl...SMILES: CC1=C(C(=C(C=C1)F)O)BrInChIKey: WPEISQLNDDJAGD-UHFFFAOYSA-NInChI: InChI=1S/C7H6BrFO/c1-4-2-3-5(9)7(10)6(4)8/h2-3,10H,1H3
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N-Cyclopropyl 3-bromo-4-fluorobenzamide
Cas Number: 639858-63-2Formula: C10H9BrFNOMolecular weight: 258.1Synonyms: 639858-63-2|3-Bromo-N-cyclopropyl-4-fluorobenzamide|N-CYCLOPROPYL 3-BROMO-4-FLUOROBENZAMIDE|3-bromo-...SMILES: C1CC1NC(=O)C2=CC(=C(C=C2)F)BrInChIKey: JXLIVLFFWYPTJI-UHFFFAOYSA-NInChI: InChI=1S/C10H9BrFNO/c11-8-5-6(1-4-9(8)12)10(14)13-7-2-3-7/h1,4-5,7H,2-3H2,(H,13,14)
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N-Hexyl 3-bromo-5-trifluoromethylbenzenesulfonamide
Cas Number: 951884-63-2Formula: C13H17BrF3NO2SMolecular weight: 388.2Synonyms: 951884-63-2|3-Bromo-N-hexyl-5-(trifluoromethyl)benzenesulfonamide|N-Hexyl 3-bromo-5-trifluoromethylb...SMILES: CCCCCCNS(=O)(=O)C1=CC(=CC(=C1)C(F)(F)F)BrInChIKey: LIMOBULHWCCRRM-UHFFFAOYSA-NInChI: InChI=1S/C13H17BrF3NO2S/c1-2-3-4-5-6-18-21(19,20)12-8-10(13(15,16)17)7-11(14)9-12/h7-9,18H,2-6H2,1H3
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3-Chloro-5-nitrophenol
Cas Number: 618-63-3Formula: C6H4ClNO3Molecular weight: 173.55Synonyms: 3-chloro-5-nitrophenol|618-63-3|MFCD15976952|Phenol, 3-chloro-5-nitro-|CL8484|SCHEMBL939204|DTXSID40...SMILES: C1=C(C=C(C=C1O)Cl)[N+](=O)[O-]InChIKey: HIZPNTCIGGXRIF-UHFFFAOYSA-NInChI: InChI=1S/C6H4ClNO3/c7-4-1-5(8(10)11)3-6(9)2-4/h1-3,9H
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1-(3-Bromophenyl)-2,2,2-trifluoroethanol
Cas Number: 446-63-9Formula: C8H6BrF3OMolecular weight: 255.03Synonyms: 1-(3-bromophenyl)-2,2,2-trifluoroethanol|446-63-9|1-(3-bromophenyl)-2,2,2-trifluoroethan-1-ol|MFCD16...SMILES: C1=CC(=CC(=C1)Br)C(C(F)(F)F)OInChIKey: YJAXYKDDEAMXAW-UHFFFAOYSA-NInChI: InChI=1S/C8H6BrF3O/c9-6-3-1-2-5(4-6)7(13)8(10,11)12/h1-4,7,13H
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1-(3-Bromo-2,4-difluorophenyl)ethanone
Cas Number: 1210824-63-7Formula: C8H5BrF2OMolecular weight: 235.03Synonyms: FT-0687071 | 1210824-63-7 | EN300-1894844 | 3'-Bromo-2',4'-difluoroacetophenone | DS-17723 | SY03542...SMILES: CC(=O)C1=C(C(=C(C=C1)F)Br)FInChIKey: NOQZJPYTXYUMAU-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrF2O/c1-4(12)5-2-3-6(10)7(9)8(5)11/h2-3H,1H3
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3-cyanocyclobutane-1-carboxylic acid
Cas Number: 1823933-75-0Formula: C6H7NO2Molecular weight: 125.13Synonyms: 3-CYANOCYCLOBUTANECARBOXYLIC ACID | 1823933-75-0 | 3-CYANOCYCLOBUTANE-1-CARBOXYLIC ACID | 2445793-26...SMILES: C1C(CC1C(=O)O)C#NInChIKey: AJZROLCXFIZNQX-UHFFFAOYSA-NInChI: InChI=1S/C6H7NO2/c7-3-4-1-5(2-4)6(8)9/h4-5H,1-2H2,(H,8,9)
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2,5-Dichloro-4,6-dimethylnicotinonitrile
Cas Number: 91591-63-8Formula: C8H6Cl2N2Molecular weight: 201.1Synonyms: 2,5-Dichloro-4,6-dimethylnicotinonitrile|91591-63-8|2,5-dichloro-4,6-dimethylpyridine-3-carbonitrile...SMILES: CC1=C(C(=NC(=C1Cl)C)Cl)C#NInChIKey: UCGWYTUBYASPFG-UHFFFAOYSA-NInChI: InChI=1S/C8H6Cl2N2/c1-4-6(3-11)8(10)12-5(2)7(4)9/h1-2H3
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4-Fluoro-3-methylbenzene-1,2-diamine hydrochloride
Cas Number: 1161426-63-6Formula: C7H10ClFN2Molecular weight: 176.62Synonyms: 4-Fluoro-3-methylbenzene-1,2-diamine hydrochloride|1161426-63-6|4-fluoro-3-methylbenzene-1,2-diamine...SMILES: CC1=C(C=CC(=C1N)N)F.ClInChIKey: IKQNHVNODYROFA-UHFFFAOYSA-NInChI: InChI=1S/C7H9FN2.ClH/c1-4-5(8)2-3-6(9)7(4)10;/h2-3H,9-10H2,1H3;1H
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