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Search results for: '54925-64-3'
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3-Acetylphenyl isocyanate
Cas Number: 23138-64-9Formula: C9H7NO2Molecular weight: 161.16Synonyms: 3-Acetylphenyl isocyanate|23138-64-9|1-(3-Isocyanatophenyl)ethanone|3-Acetylphenylisocyanate|Ethanon...SMILES: CC(=O)C1=CC(=CC=C1)N=C=OInChIKey: JASTZOAHAWBRLM-UHFFFAOYSA-NInChI: InChI=1S/C9H7NO2/c1-7(12)8-3-2-4-9(5-8)10-6-11/h2-5H,1H3
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3-(Cyclohexyloxy)Methylphenylboronic acid
Cas Number: 1256358-64-1Formula: C13H19BO3Molecular weight: 234.1Synonyms: 1256358-64-1|(3-((Cyclohexyloxy)methyl)phenyl)boronic acid|3-(CYCLOHEXYLOXY)METHYLPHENYLBORONIC ACID...SMILES: B(C1=CC(=CC=C1)COC2CCCCC2)(O)OInChIKey: HWXMWQGTMQLXJQ-UHFFFAOYSA-NInChI: InChI=1S/C13H19BO3/c15-14(16)12-6-4-5-11(9-12)10-17-13-7-2-1-3-8-13/h4-6,9,13,15-16H,1-3,7-8,10H2
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3-(2-chloropyrimidin-5-yl)-5,5-dimethyl-imidazolidine-2,4-dione
Cas Number: 1380698-64-5Formula: C9H9N4O2ClMolecular weight: 240.65Synonyms: SCHEMBL9900172 | 3-(2-chloropyrimidin-5-yl)-5,5-dimethyl-imidazolidine-2,4-dione | 1380698-64-5 | E8...SMILES: CC1(C(=O)N(C(=O)N1)C2=CN=C(N=C2)Cl)CInChIKey: PSZQSCBUJVBSOR-UHFFFAOYSA-NInChI: InChI=1S/C9H9ClN4O2/c1-9(2)6(15)14(8(16)13-9)5-3-11-7(10)12-4-5/h3-4H,1-2H3,(H,13,16)
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methyl pyrazolo[1,5-a]pyrazine-3-carboxylate
Cas Number: 53902-64-0Formula: C8H7N3O2Molecular weight: 177.16Synonyms: methyl pyrazolo[1,5-a]pyrazine-3-carboxylate | 53902-64-0 | MFCD19443873 | AKOS037649179 | BS-16972 ...SMILES: COC(=O)C1=C2C=NC=CN2N=C1InChIKey: WYJOSLTYQGWJBW-UHFFFAOYSA-NInChI: InChI=1S/C8H7N3O2/c1-13-8(12)6-4-10-11-3-2-9-5-7(6)11/h2-5H,1H3
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3-(4-(Bromomethyl)-3-fluorophenyl)-1,2,4-oxadiazole
Cas Number: 1146699-64-0Formula: C9H6BrFN2OMolecular weight: 257.06Synonyms: 3-(4-(Bromomethyl)-3-fluorophenyl)-1,2,4-oxadiazole|1146699-64-0|3-[4-(bromomethyl)-3-fluorophenyl]-...SMILES: C1=CC(=C(C=C1C2=NOC=N2)F)CBrInChIKey: ZBKXTEJUTGXVJL-UHFFFAOYSA-NInChI: InChI=1S/C9H6BrFN2O/c10-4-7-2-1-6(3-8(7)11)9-12-5-14-13-9/h1-3,5H,4H2
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Methyl 3-bromo-5-ethoxybenzoate
Cas Number: 860695-64-3Formula: C10H11BrO3Molecular weight: 259.1Synonyms: METHYL 3-BROMO-5-ETHOXYBENZOATE|860695-64-3|Methyl3-bromo-5-ethoxybenzoate|SCHEMBL16397245|DTXSID706...SMILES: CCOC1=CC(=CC(=C1)C(=O)OC)BrInChIKey: KXRZCRIKLQRDKT-UHFFFAOYSA-NInChI: InChI=1S/C10H11BrO3/c1-3-14-9-5-7(10(12)13-2)4-8(11)6-9/h4-6H,3H2,1-2H3
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3-(Trifluoromethyl)-4-methylphenyl isocyanate
Cas Number: 51903-64-1Formula: C9H6F3NOMolecular weight: 201.15Synonyms: 51903-64-1|4-Methyl-3-(trifluoromethyl)phenylisocyanate|4-isocyanato-1-methyl-2-(trifluoromethyl)ben...SMILES: CC1=C(C=C(C=C1)N=C=O)C(F)(F)FInChIKey: XWSZWQGFJRBXMO-UHFFFAOYSA-NInChI: InChI=1S/C9H6F3NO/c1-6-2-3-7(13-5-14)4-8(6)9(10,11)12/h2-4H,1H3
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Ethyl isovalerate
Formula: C7H14O2Molecular weight: 130.18Synonyms: ETHYL ISOVALERATE|108-64-5|Ethyl 3-methylbutanoate|Ethyl 3-methylbutyrate|Ethylisovalerate|Ethyl iso...SMILES: CCOC(=O)CC(C)CInChIKey: PPXUHEORWJQRHJ-UHFFFAOYSA-NInChI: InChI=1S/C7H14O2/c1-4-9-7(8)5-6(2)3/h6H,4-5H2,1-3H3
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1-Benzoyl-3-(4-cyanophenyl)thiourea
Cas Number: 1448-64-2Formula: C15H11N3OSMolecular weight: 281.3Synonyms: 1-Benzoyl-3-(4-cyanophenyl)thiourea|1448-64-2|N-[(4-cyanophenyl)carbamothioyl]benzamide|3-benzoyl-1-...SMILES: C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C#NInChIKey: FEECPKRZFPEEEU-UHFFFAOYSA-NInChI: InChI=1S/C15H11N3OS/c16-10-11-6-8-13(9-7-11)17-15(20)18-14(19)12-4-2-1-3-5-12/h1-9H,(H2,17,18,19,20)
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3-(Benzyloxy)propan-1-amine
Cas Number: 16728-64-6Formula: C10H15NOMolecular weight: 165.23Synonyms: 3-(benzyloxy)propan-1-amine|16728-64-6|3-phenylmethoxypropan-1-amine|3-benzyloxypropylamine|1-PROPAN...SMILES: C1=CC=C(C=C1)COCCCNInChIKey: QFHLJYPKYWISHS-UHFFFAOYSA-NInChI: InChI=1S/C10H15NO/c11-7-4-8-12-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9,11H2
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6-Formylnicotinonitrile
Cas Number: 206201-64-1Formula: C7H4N2OMolecular weight: 132.12Synonyms: 6-Formylnicotinonitrile|206201-64-1|6-FORMYLPYRIDINE-3-CARBONITRILE|6-FORMYL-3-PYRIDINECARBONITRILE|...SMILES: C1=CC(=NC=C1C#N)C=OInChIKey: DMDMMMFMXWZSLM-UHFFFAOYSA-NInChI: InChI=1S/C7H4N2O/c8-3-6-1-2-7(5-10)9-4-6/h1-2,4-5H
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3-(oxan-4-yl)-3-oxopropanenitrile
Cas Number: 1010798-64-7Formula: C8H11NO2Molecular weight: 153.181Synonyms: 3-Oxo-3-(tetrahydro-2H-pyran-4-yl)propanenitrile|1010798-64-7|3-(oxan-4-yl)-3-oxopropanenitrile|2H-P...SMILES: C1COCCC1C(=O)CC#NInChIKey: BEMLWTKUQPQXNH-UHFFFAOYSA-NInChI: InChI=1S/C8H11NO2/c9-4-1-8(10)7-2-5-11-6-3-7/h7H,1-3,5-6H2
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3-Bromo-4-cyanoindole
Cas Number: 1186663-64-8Formula: C9H5BrN2Molecular weight: 221.1Synonyms: 3-BROMO-4-CYANOINDOLE|1186663-64-8|3-BROMO-1H-INDOLE-4-CARBONITRILE|MFCD12828700|SCHEMBL3778298|DTXS...SMILES: C1=CC(=C2C(=C1)NC=C2Br)C#NInChIKey: FFSJNHMOWYMQJQ-UHFFFAOYSA-NInChI: InChI=1S/C9H5BrN2/c10-7-5-12-8-3-1-2-6(4-11)9(7)8/h1-3,5,12H
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methyl 4-(hydroxymethyl)bicyclo[2.1.1]hexane-1-carboxylate
Cas Number: 2090676-64-3Formula: C9H14O3Molecular weight: 170.21Synonyms: methyl 4-(hydroxymethyl)bicyclo[2.1.1]hexane-1-carboxylate | 2090676-64-3 | SCHEMBL22806984 | CS-031...SMILES: COC(=O)C12CCC(C1)(C2)COInChIKey: JWCNUNHJCKGXDJ-UHFFFAOYSA-NInChI: InChI=1S/C9H14O3/c1-12-7(11)9-3-2-8(4-9,5-9)6-10/h10H,2-6H2,1H3
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3-amino-3-methylcyclobutan-1-ol hydrochloride
Cas Number: 1403766-64-2Formula: C5H12ClNOMolecular weight: 137.608Synonyms: 1403766-64-2|1403766-99-3|1403767-32-7|cis-3-Amino-3-methylcyclobutanol hydrochloride|3-amino-3-meth...SMILES: CC1(CC(C1)O)N.ClInChIKey: RTAWFZMTTJCICN-UHFFFAOYSA-NInChI: InChI=1S/C5H11NO.ClH/c1-5(6)2-4(7)3-5;/h4,7H,2-3,6H2,1H3;1H
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3-Cyclopropylaniline
Cas Number: 485402-64-0Formula: C9H11NMolecular weight: 133.19Synonyms: 3-Cyclopropylaniline|485402-64-0|Benzenamine, 3-cyclopropyl-|MFCD06802404|3-cyclopropyl aniline|3-cy...SMILES: C1CC1C2=CC(=CC=C2)NInChIKey: LKJYNYKTZLTHJN-UHFFFAOYSA-NInChI: InChI=1S/C9H11N/c10-9-3-1-2-8(6-9)7-4-5-7/h1-3,6-7H,4-5,10H2
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tert-butyl 3-fluoro-3-(iodomethyl)azetidine-1-carboxylate
Cas Number: 1374657-64-3Formula: C9H15FINO2Molecular weight: 315.13Synonyms: 1-Boc-3-iodomethyl-3-fluoroazetidine | 1374657-64-3 | TERT-BUTYL 3-FLUORO-3-(IODOMETHYL)AZETIDINE-1-...SMILES: CC(C)(C)OC(=O)N1CC(C1)(CI)FInChIKey: ZJDAPUKBGDZCHT-UHFFFAOYSA-NInChI: InChI=1S/C9H15FINO2/c1-8(2,3)14-7(13)12-5-9(10,4-11)6-12/h4-6H2,1-3H3
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5,6-Dibromonicotinic acid
Cas Number: 29241-64-3Formula: C6H3Br2NO2Molecular weight: 280.9Synonyms: 5,6-dibromonicotinic acid|29241-64-3|5,6-dibromopyridine-3-carboxylic acid|3-Pyridinecarboxylic acid...SMILES: C1=C(C=NC(=C1Br)Br)C(=O)OInChIKey: ABBCIGFWDCOGEQ-UHFFFAOYSA-NInChI: InChI=1S/C6H3Br2NO2/c7-4-1-3(6(10)11)2-9-5(4)8/h1-2H,(H,10,11)
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Ferbam
Cas Number: 14484-64-1Formula: C9H18FeN3S6Molecular weight: 416.49Synonyms: Ferbam|14484-64-1|Ferric dimethyldithiocarbamate|Iron(III) dimethyldithiocarbamate|Trimanzone|DTXSID...SMILES: CN(C)C(=S)[S-].CN(C)C(=S)[S-].CN(C)C(=S)[S-].[Fe+3]InChIKey: WHDGWKAJBYRJJL-UHFFFAOYSA-KInChI: InChI=1S/3C3H7NS2.Fe/c3*1-4(2)3(5)6;/h3*1-2H3,(H,5,6);/q;;;+3/p-3
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3-Fluoro-5-(diethylcarbamoyl)phenylboronic acid
Cas Number: 871332-64-8Formula: C11H15BFNO3Molecular weight: 239.1Synonyms: 871332-64-8|3-Fluoro-5-(diethylcarbamoyl)phenylboronic acid|(3-(Diethylcarbamoyl)-5-fluorophenyl)bor...SMILES: B(C1=CC(=CC(=C1)F)C(=O)N(CC)CC)(O)OInChIKey: PWFQDNPXVAYCOK-UHFFFAOYSA-NInChI: InChI=1S/C11H15BFNO3/c1-3-14(4-2)11(15)8-5-9(12(16)17)7-10(13)6-8/h5-7,16-17H,3-4H2,1-2H3
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6-Benzyloxyindole-3-carboxaldehyde
Cas Number: 92855-64-6Formula: C16H13NO2Molecular weight: 251.3Synonyms: 92855-64-6|6-BENZYLOXYINDOLE-3-CARBALDEHYDE|6-Benzyloxyindole-3-carboxaldehyde|6-(benzyloxy)-1H-indo...SMILES: C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=CN3)C=OInChIKey: UUKFCVCTRWNXBI-UHFFFAOYSA-NInChI: InChI=1S/C16H13NO2/c18-10-13-9-17-16-8-14(6-7-15(13)16)19-11-12-4-2-1-3-5-12/h1-10,17H,11H2
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[trans-3-(aminomethyl)cyclobutyl]methanol;hydrochloride
Cas Number: 1778734-64-7Synonyms: [cis-3-(Aminomethyl)cyclobutyl]methanol HCl | [cis-3-(Aminomethyl)cyclobutyl]methanol hydrochloride ...SMILES: C1C(CC1CO)CN.ClInChIKey: KAFPROAYXUBOEX-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO.ClH/c7-3-5-1-6(2-5)4-8;/h5-6,8H,1-4,7H2;1H
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3-nitropyrazolo[1,5-a]pyrimidine
Cas Number: 55405-64-6Formula: C6H4N4O2Molecular weight: 164.124Synonyms: 3-nitropyrazolo[1,5-a]pyrimidine|55405-64-6|MFCD00501922|SCHEMBL7792276|DTXSID90350743|FDOREHMGSRCRR...SMILES: C1=CN2C(=C(C=N2)[N+](=O)[O-])N=C1InChIKey: FDOREHMGSRCRRM-UHFFFAOYSA-NInChI: InChI=1S/C6H4N4O2/c11-10(12)5-4-8-9-3-1-2-7-6(5)9/h1-4H
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(3-Fluoro-4-methylphenyl)hydrazine hydrochloride
Cas Number: 156941-64-9Formula: C7H10ClFN2Molecular weight: 176.62Synonyms: 156941-64-9|(3-Fluoro-4-Methylphenyl)Hydrazine Hydrochloride|3-Fluoro-4-methylphenylhydrazine hydroc...SMILES: CC1=C(C=C(C=C1)NN)F.ClInChIKey: APQFRSWQIFVTQI-UHFFFAOYSA-NInChI: InChI=1S/C7H9FN2.ClH/c1-5-2-3-6(10-9)4-7(5)8;/h2-4,10H,9H2,1H3;1H
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