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Search results for: '2227206-61-1'
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1-(3-Bromobenzyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane
Cas Number: 951885-61-3Formula: C13H15BrO3Molecular weight: 299.2Synonyms: 1-(3-Bromobenzyl)-4-methyl-2,6,7-trioxabicyclo[2.2.2]octane|951885-61-3|1-[(3-bromophenyl)methyl]-4-...SMILES: CC12COC(OC1)(OC2)CC3=CC(=CC=C3)BrInChIKey: QJWQIXCPAVGZDM-UHFFFAOYSA-NInChI: InChI=1S/C13H15BrO3/c1-12-7-15-13(16-8-12,17-9-12)6-10-3-2-4-11(14)5-10/h2-5H,6-9H2,1H3
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4-bromo-5-chloro-2-methylpyridine hydrobromide
Cas Number: 2227206-20-2Formula: C6H6Br2ClNMolecular weight: 287.38Synonyms: 4-Bromo-5-chloro-2-methylpyridine hydrobromide | 2227206-20-2 | 4-BROMO-5-CHLORO-2-METHYLPYRIDINE HB...SMILES: CC1=CC(=C(C=N1)Cl)Br.BrInChIKey: XJMGEELBONNGKI-UHFFFAOYSA-NInChI: InChI=1S/C6H5BrClN.BrH/c1-4-2-5(7)6(8)3-9-4;/h2-3H,1H3;1H
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4-(chloromethyl)piperidine hydrochloride
Cas Number: 1822-61-3Formula: C6H13Cl2NMolecular weight: 170.08Synonyms: 1822-61-3|4-Chloromethyl-piperidine hydrochloride|4-(CHLOROMETHYL)PIPERIDINE HYDROCHLORIDE|4-(CHLORO...SMILES: C1CNCCC1CCl.ClInChIKey: XLHLVPVJPDGPBC-UHFFFAOYSA-NInChI: InChI=1S/C6H12ClN.ClH/c7-5-6-1-3-8-4-2-6;/h6,8H,1-5H2;1H
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6-Methoxy-1-naphthoic acid
Cas Number: 36112-61-5Formula: C12H10O3Molecular weight: 202.21Synonyms: 6-Methoxy-1-naphthoic acid|36112-61-5|6-methoxynaphthalene-1-carboxylic Acid|6-methoxynaphthoic acid...SMILES: COC1=CC2=C(C=C1)C(=CC=C2)C(=O)OInChIKey: WRZAWKSSADRYTA-UHFFFAOYSA-NInChI: InChI=1S/C12H10O3/c1-15-9-5-6-10-8(7-9)3-2-4-11(10)12(13)14/h2-7H,1H3,(H,13,14)
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3-(hydroxymethyl)-1-methyl-1,2-dihydropyridin-2-one
Cas Number: 36721-61-6Formula: C7H9NO2Molecular weight: 139.154Synonyms: 36721-61-6|1-METHYL-2-OXO-1,2-DIHYDROPYRIDINE-3-METHANOL|3-(HYDROXYMETHYL)-1-METHYLPYRIDIN-2(1H)-ONE...SMILES: CN1C=CC=C(C1=O)COInChIKey: ILPQOFRAYWDXCJ-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO2/c1-8-4-2-3-6(5-9)7(8)10/h2-4,9H,5H2,1H3
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3-(benzyloxy)cyclopentan-1-ol
Cas Number: 905961-61-7Formula: C12H16O2Molecular weight: 192.258Synonyms: 3-(benzyloxy)cyclopentan-1-ol|905961-61-7|3-(Benzyloxy)cyclopentanol|3-phenylmethoxycyclopentan-1-ol...SMILES: C1CC(CC1O)OCC2=CC=CC=C2InChIKey: SFIICXXRMNDRQC-UHFFFAOYSA-NInChI: InChI=1S/C12H16O2/c13-11-6-7-12(8-11)14-9-10-4-2-1-3-5-10/h1-5,11-13H,6-9H2
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2,4-Difluoropyrimidine
Cas Number: 2802-61-1Formula: C4H2F2N2Molecular weight: 116.07Synonyms: 2,4-Difluoropyrimidine|2802-61-1|2,4-Difluoro-pyrimidine|Pyrimidine,2,4-difluoro-|Pyrimidine, 2,4-di...SMILES: C1=CN=C(N=C1F)FInChIKey: JZSYSXZDIQUOGP-UHFFFAOYSA-NInChI: InChI=1S/C4H2F2N2/c5-3-1-2-7-4(6)8-3/h1-2H
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1-Bromo-3-fluoro-5-piperidinobenzene, HCl
Cas Number: 1242336-61-3Formula: C11H14BrClFNMolecular weight: 294.6Synonyms: 1242336-61-3|1-(3-Bromo-5-fluorophenyl)piperidine hydrochloride|1-Bromo-3-fluoro-5-piperidinobenzene...SMILES: C1CCN(CC1)C2=CC(=CC(=C2)Br)F.ClInChIKey: HLKGOCKBYCONPS-UHFFFAOYSA-NInChI: InChI=1S/C11H13BrFN.ClH/c12-9-6-10(13)8-11(7-9)14-4-2-1-3-5-14;/h6-8H,1-5H2;1H
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1-Benzyl-3-aminomethylpyrrolidine
Cas Number: 93138-61-5Formula: C12H18N2Molecular weight: 190.3Synonyms: 93138-61-5|(1-benzylpyrrolidin-3-yl)methanamine|1-Benzyl-3-aminomethylpyrrolidine|3-(Aminomethyl)-1-...SMILES: C1CN(CC1CN)CC2=CC=CC=C2InChIKey: SUAKIVNGQVUKJA-UHFFFAOYSA-NInChI: InChI=1S/C12H18N2/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11/h1-5,12H,6-10,13H2
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2-(Benzyloxy)-1-chloro-4-nitrobenzene
Cas Number: 76464-61-4Formula: C13H10ClNO3Molecular weight: 263.7Synonyms: 2-(Benzyloxy)-1-chloro-4-nitrobenzene|76464-61-4|1-chloro-4-nitro-2-phenylmethoxybenzene|SCHEMBL9441...SMILES: C1=CC=C(C=C1)COC2=C(C=CC(=C2)[N+](=O)[O-])ClInChIKey: DXQRYHUPOMREGK-UHFFFAOYSA-NInChI: InChI=1S/C13H10ClNO3/c14-12-7-6-11(15(16)17)8-13(12)18-9-10-4-2-1-3-5-10/h1-8H,9H2
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BAY 61-3606 dihydrochloride
Cas Number: 648903-57-5Formula: C20H20Cl2N6O3Molecular weight: 463.32Synonyms: MS-28520 | 2-(7-(3,4-Dimethoxyphenyl)imidazo(1,2-c)pyrimidin-5-ylamino)nicotinamide dihydrochloride ...SMILES: COC1=C(C=C(C=C1)C2=CC3=NC=CN3C(=N2)NC4=C(C=CC=N4)C(=O)N)OC.Cl.ClInChIKey: SPMFEULFGGPQLN-UHFFFAOYSA-NInChI: InChI=1S/C20H18N6O3.2ClH/c1-28-15-6-5-12(10-16(15)29-2)14-11-17-22-8-9-26(17)20(24-14)25-19-13(18(21)27)4-3-7-23-19;;/h3-11H,1-2H3,(H2,21,27)(H,23,24,25);2*1H
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tert-butyl 6-iodo-2-azaspiro[3.3]heptane-2-carboxylate
Cas Number: 2059140-61-1Formula: C11H18NO2IMolecular weight: 323.17Synonyms: tert-Butyl 6-iodo-2-azaspiro[3.3]heptane-2-carboxylate | 2059140-61-1 | SCHEMBL18357612 | AT12402 | ...SMILES: CC(C)(C)OC(=O)N1CC2(C1)CC(C2)IInChIKey: KHHIVFVMZWYGOH-UHFFFAOYSA-NInChI: InChI=1S/C11H18INO2/c1-10(2,3)15-9(14)13-6-11(7-13)4-8(12)5-11/h8H,4-7H2,1-3H3
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1-Ethyl-3-MethyliMidazoliuMHydrogenSulfate
Cas Number: 674282-83-8Formula: C6H12N2O4SMolecular weight: 208.235Synonyms: 1-Ethyl-3-methylimidazolium hydrogen sulfate|412009-61-1|1-ETHYL-3-METHYLIMIDAZOLIUM HYDROGENSULFATE...SMILES: CCN1C=C[N+](=C1)C.OS(=O)(=O)[O-]InChIKey: HZKDSQCZNUUQIF-UHFFFAOYSA-MInChI: InChI=1S/C6H11N2.H2O4S/c1-3-8-5-4-7(2)6-8;1-5(2,3)4/h4-6H,3H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1
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tert-butyl 4-(2,2-dibromoethenyl)piperidine-1-carboxylate
Synonyms: 203664-61-3|TERT-BUTYL 4-(2,2-DIBROMOVINYL)PIPERIDINE-1-CARBOXYLATE|Tert-butyl 4-(2,2-dibromoethenyl...SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C=C(Br)BrInChIKey: MBNHUCDXSFFRLG-UHFFFAOYSA-NInChI: InChI=1S/C12H19Br2NO2/c1-12(2,3)17-11(16)15-6-4-9(5-7-15)8-10(13)14/h8-9H,4-7H2,1-3H3
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9-(CHLOROACETYL)CARBAZOLE
Cas Number: 38002-61-8Formula: C14H10ClNOMolecular weight: 243.695Synonyms: 9-(chloroacetyl)-9H-carbazole|38002-61-8|1-carbazol-9-yl-2-chloroethanone|1-(9H-carbazol-9-yl)-2-chl...SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2C(=O)CClInChIKey: NIZUEICMEHKRKX-UHFFFAOYSA-NInChI: InChI=1S/C14H10ClNO/c15-9-14(17)16-12-7-3-1-5-10(12)11-6-2-4-8-13(11)16/h1-8H,9H2
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trans-4-methoxycyclohexane-1-carboxylic acid
Synonyms: 4-METHOXYCYCLOHEXANECARBOXYLIC ACID|95233-12-8|73873-61-7|trans-4-methoxycyclohexanecarboxylic acid|...SMILES: COC1CCC(CC1)C(=O)OInChIKey: WKILSRYNRQGRMA-UHFFFAOYSA-NInChI: InChI=1S/C8H14O3/c1-11-7-4-2-6(3-5-7)8(9)10/h6-7H,2-5H2,1H3,(H,9,10)
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tert-Butyl 2-vinylpiperidine-1-carboxylate
Synonyms: tert-butyl 2-Vinylpiperidine-1-carboxylate|176324-61-1|1-Boc-2-vinylpiperidine|TERT-BUTYL 2-ETHENYLP...SMILES: CC(C)(C)OC(=O)N1CCCCC1C=CInChIKey: RZTACBWUQPTZHE-UHFFFAOYSA-NInChI: InChI=1S/C12H21NO2/c1-5-10-8-6-7-9-13(10)11(14)15-12(2,3)4/h5,10H,1,6-9H2,2-4H3
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2-(1H-Imidazol-1-yl)-6-trifluoromethylpyridine
Cas Number: 1215266-61-7Formula: C9H6F3N3Molecular weight: 213.2Synonyms: 1215266-61-7|2-(1H-Imidazol-1-yl)-6-(trifluoromethyl)pyridine|2-(1H-IMIDAZOL-1-YL)-6-TRIFLUOROMETHYL...SMILES: C1=CC(=NC(=C1)N2C=CN=C2)C(F)(F)FInChIKey: JPUQWWQTPRLRLB-UHFFFAOYSA-NInChI: InChI=1S/C9H6F3N3/c10-9(11,12)7-2-1-3-8(14-7)15-5-4-13-6-15/h1-6H
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(S)-2-Methylpiperidine hydrochloride
Cas Number: 205526-61-0Formula: C6H14ClNMolecular weight: 135.63Synonyms: (S)-2-Methylpiperidine hydrochloride|205526-61-0|(2S)-2-methylpiperidine;hydrochloride|(S)-2-Methylp...SMILES: CC1CCCCN1.ClInChIKey: BILCQNXKQKRGAO-RGMNGODLSA-NInChI: InChI=1S/C6H13N.ClH/c1-6-4-2-3-5-7-6;/h6-7H,2-5H2,1H3;1H/t6-;/m0./s1
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2-Bromo-5-fluorobenzyl chloride
Cas Number: 857276-61-0Formula: C7H5BrClFMolecular weight: 223.5Synonyms: 857276-61-0|2-BROMO-5-FLUOROBENZYL CHLORIDE|2-Bromo-5-fluorobenzylchloride|1-bromo-2-(chloromethyl)-...SMILES: C1=CC(=C(C=C1F)CCl)BrInChIKey: OPMKPLUMLVBPET-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrClF/c8-7-2-1-6(10)3-5(7)4-9/h1-3H,4H2
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(2S,4S)-1-tert-butoxycarbonyl-4-(difluoromethoxymethyl)pyrrolidine-2-carboxylic acid
Cas Number: 1378389-61-7Formula: C12H19NO5F2Molecular weight: 295.28Synonyms: 1378389-61-7 | (2S,4S)-1-(tert-butoxycarbonyl)-4-((difluoromethoxy)methyl)pyrrolidine-2-carboxylic a...SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)COC(F)FInChIKey: MVSMHEQSPFMSKF-YUMQZZPRSA-NInChI: InChI=1S/C12H19F2NO5/c1-12(2,3)20-11(18)15-5-7(6-19-10(13)14)4-8(15)9(16)17/h7-8,10H,4-6H2,1-3H3,(H,16,17)/t7-,8-/m0/s1
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3,4-Dihydroxyhydrocinnamic acid
Cas Number: 1078-61-1Formula: C9H10O4Molecular weight: 182.17Synonyms: Dihydrocaffeic acid|1078-61-1|3-(3,4-Dihydroxyphenyl)propionic acid|3-(3,4-Dihydroxyphenyl)propanoic...SMILES: C1=CC(=C(C=C1CCC(=O)O)O)OInChIKey: DZAUWHJDUNRCTF-UHFFFAOYSA-NInChI: InChI=1S/C9H10O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5,10-11H,2,4H2,(H,12,13)
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1-(2-amino-5-bromo-3-pyridyl)ethanone
Cas Number: 1196154-61-6Formula: C7H7N2OBrMolecular weight: 215.05Synonyms: 1196154-61-6 | 1-(2-AMINO-5-BROMOPYRIDIN-3-YL)ETHANONE | 1-(2-AMINO-5-BROMOPYRIDIN-3-YL)ETHAN-1-ONE ...SMILES: CC(=O)C1=C(N=CC(=C1)Br)NInChIKey: SEKSQHBOPVONLC-UHFFFAOYSA-NInChI: InChI=1S/C7H7BrN2O/c1-4(11)6-2-5(8)3-10-7(6)9/h2-3H,1H3,(H2,9,10)
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1-benzyl-N-methyl-azetidin-3-amine dihydrochloride
Cas Number: 292163-61-2Synonyms: 292163-61-2 | 1-benzyl-N-methyl-azetidin-3-amine dihydrochloride | 1-Benzyl-N-methylazetidin-3-amine...SMILES: CNC1CN(C1)CC2=CC=CC=C2.Cl.ClInChIKey: HXNRZQQNFAMUJH-UHFFFAOYSA-NInChI: InChI=1S/C11H16N2.2ClH/c1-12-11-8-13(9-11)7-10-5-3-2-4-6-10;;/h2-6,11-12H,7-9H2,1H3;2*1H
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