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Search results for: '98105-45-4'
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4-Bromo-3,5-dichloropyridine
Cas Number: 343781-45-3Formula: C5H2BrCl2NMolecular weight: 226.9Synonyms: 4-BROMO-3,5-DICHLOROPYRIDINE|343781-45-3|MFCD06797978|3,5-DICHLORO-4-BROMO-PYRIDINE|SCHEMBL7905113|D...SMILES: C1=C(C(=C(C=N1)Cl)Br)ClInChIKey: LOKLQBZBVPYAQO-UHFFFAOYSA-NInChI: InChI=1S/C5H2BrCl2N/c6-5-3(7)1-9-2-4(5)8/h1-2H
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1-[(tert-butoxy)carbonyl]-4-(methoxycarbonyl)piperidine-4-carboxylic acid
Cas Number: 1005738-45-3Formula: C13H21NO6Molecular weight: 287.312Synonyms: 1005738-45-3|1-[(tert-butoxy)carbonyl]-4-(methoxycarbonyl)piperidine-4-carboxylic acid|1-(tert-butox...SMILES: CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)C(=O)OCInChIKey: MFPPLBPVSINTPM-UHFFFAOYSA-NInChI: InChI=1S/C13H21NO6/c1-12(2,3)20-11(18)14-7-5-13(6-8-14,9(15)16)10(17)19-4/h5-8H2,1-4H3,(H,15,16)
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2-Pyrimidinemethanamine
Cas Number: 75985-45-4Formula: C5H7N3Molecular weight: 109.13Synonyms: 2-PYRIMIDINEMETHANAMINE|75985-45-4|Pyrimidin-2-ylmethanamine|2-Aminomethylpyrimidine|2-(Aminomethyl)...SMILES: C1=CN=C(N=C1)CNInChIKey: ROSKZJGILXBSFM-UHFFFAOYSA-NInChI: InChI=1S/C5H7N3/c6-4-5-7-2-1-3-8-5/h1-3H,4,6H2
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2,2':6',2''-Terpyridine-4'-carboxaldehyde
Cas Number: 108295-45-0Formula: C16H11N3OMolecular weight: 261.28Synonyms: 108295-45-0|[2,2':6',2''-terpyridine]-4'-carbaldehyde|2,6-dipyridin-2-ylpyridine-4-carbaldehyde|[2,2...SMILES: C1=CC=NC(=C1)C2=CC(=CC(=N2)C3=CC=CC=N3)C=OInChIKey: MEMKUPMTILFZQJ-UHFFFAOYSA-NInChI: InChI=1S/C16H11N3O/c20-11-12-9-15(13-5-1-3-7-17-13)19-16(10-12)14-6-2-4-8-18-14/h1-11H
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4-Bromo-N-ethyl-2-nitroaniline
Cas Number: 56136-82-4Formula: C8H9BrN2O2Molecular weight: 245.1Synonyms: 4-BROMO-N-ETHYL-2-NITROANILINE|56136-82-4|(4-Bromo-2-nitro-phenyl)-ethyl-amine|SCHEMBL594213|AMY4781...SMILES: CCNC1=C(C=C(C=C1)Br)[N+](=O)[O-]InChIKey: VRIRIGHMWUIJSH-UHFFFAOYSA-NInChI: InChI=1S/C8H9BrN2O2/c1-2-10-7-4-3-6(9)5-8(7)11(12)13/h3-5,10H,2H2,1H3
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(4S)-4-phenylpyrrolidin-2-one
Cas Number: 62624-45-7Formula: C10H11NOMolecular weight: 161.2Synonyms: (S)-4-PHENYLPYRROLIDIN-2-ONE | 62624-45-7 | (4S)-4-phenylpyrrolidin-2-one | 4(s)-phenyl-2-pyrrolidin...SMILES: C1C(CNC1=O)C2=CC=CC=C2InChIKey: HOJZEMQCQRPLQQ-SECBINFHSA-NInChI: InChI=1S/C10H11NO/c12-10-6-9(7-11-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,11,12)/t9-/m1/s1
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2,3-Difluoro-4-methylphenol
Cas Number: 261763-45-5Formula: C7H6F2OMolecular weight: 144.1Synonyms: 2,3-Difluoro-4-methylphenol|261763-45-5|Phenol, 2,3-difluoro-4-methyl-|MFCD01631651|2,3-difluoro-4-m...SMILES: CC1=C(C(=C(C=C1)O)F)FInChIKey: NVYIUITYVMVHJM-UHFFFAOYSA-NInChI: InChI=1S/C7H6F2O/c1-4-2-3-5(10)7(9)6(4)8/h2-3,10H,1H3
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2-Nitro-4-thiocyanatoaniline
Cas Number: 54029-45-7 EC Number: 258-931-5Formula: O2NC6H3(SCN)NH2Molecular weight: 195.2Synonyms: 4-Amino-3-nitrophenyl thiocyanate # | 4-thiocyano-2-nitroaniline | A802127 | CAS-54029-45-7 | (4-ami...SMILES: C1=CC(=C(C=C1SC#N)[N+](=O)[O-])NInChIKey: QUWHIBBGKKRYFW-UHFFFAOYSA-NInChI: InChI=1S/C7H5N3O2S/c8-4-13-5-1-2-6(9)7(3-5)10(11)12/h1-3H,9H2
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4-Fluoro-2-(hydroxymethyl)phenylboronic acid
Cas Number: 1061223-45-7Formula: C7H8BFO3Molecular weight: 169.9Synonyms: 1061223-45-7|(4-Fluoro-2-(hydroxymethyl)phenyl)boronic acid|4-Fluoro-2-(hydroxymethyl)phenylboronic ...SMILES: B(C1=C(C=C(C=C1)F)CO)(O)OInChIKey: WDCNOFNVHZOFOW-UHFFFAOYSA-NInChI: InChI=1S/C7H8BFO3/c9-6-1-2-7(8(11)12)5(3-6)4-10/h1-3,10-12H,4H2
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4-(Hydroxymethyl)-2-isopropylthiazole
Cas Number: 133047-45-7Formula: C7H11NOSMolecular weight: 157.2Synonyms: 133047-45-7|4-(Hydroxymethyl)-2-isopropylthiazole|(2-Isopropylthiazol-4-yl)methanol|4-Thiazolemethan...SMILES: CC(C)C1=NC(=CS1)COInChIKey: DRSAHDPLRNPPMJ-UHFFFAOYSA-NInChI: InChI=1S/C7H11NOS/c1-5(2)7-8-6(3-9)4-10-7/h4-5,9H,3H2,1-2H3
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O4-tert-butyl O6-ethyl 7-oxo-4-azaspiro[2.5]octane-4,6-dicarboxylate
Cas Number: 2411640-45-2Formula: C15H23NO5Molecular weight: 297.35Synonyms: 2411640-45-2 | O4-tert-butyl O6-ethyl 7-oxo-4-azaspiro[2.5]octane-4,6-dicarboxylate | MFCD32900651 |...SMILES: CCOC(=O)C1CN(C2(CC2)CC1=O)C(=O)OC(C)(C)CInChIKey: FOXANQGWZGGWSC-UHFFFAOYSA-NInChI: InChI=1S/C15H23NO5/c1-5-20-12(18)10-9-16(13(19)21-14(2,3)4)15(6-7-15)8-11(10)17/h10H,5-9H2,1-4H3
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4-Amino-5,6-dimethoxypyrimidine
Cas Number: 5018-45-1Formula: C6H9N3O2Molecular weight: 155.16Synonyms: 4-Amino-5,6-dimethoxypyrimidine|5018-45-1|5,6-Dimethoxypyrimidin-4-amine|5,6-Dimethoxypyrimidin-4-yl...SMILES: COC1=C(N=CN=C1OC)NInChIKey: OBYHDGNNFIOYSU-UHFFFAOYSA-NInChI: InChI=1S/C6H9N3O2/c1-10-4-5(7)8-3-9-6(4)11-2/h3H,1-2H3,(H2,7,8,9)
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(2S)-2-methylpiperidin-4-one hydrochloride
Cas Number: 790667-45-7Formula: C6H12ClNOMolecular weight: 149.62Synonyms: 790667-45-7|(S)-2-Methylpiperidin-4-one hydrochloride|2-(S)-Methyl-4-piperidinone hydrochloride|(2S)...SMILES: CC1CC(=O)CCN1.ClInChIKey: ACXLFVKOKDSUOU-JEDNCBNOSA-NInChI: InChI=1S/C6H11NO.ClH/c1-5-4-6(8)2-3-7-5;/h5,7H,2-4H2,1H3;1H/t5-;/m0./s1
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5-chloro-4-methyl-2,3-dihydropyridazin-3-one
Cas Number: 104566-45-2Formula: C5H5ClN2OMolecular weight: 144.56Synonyms: 5-chloro-4-methyl-2,3-dihydropyridazin-3-one|104566-45-2|4-chloro-5-methyl-1H-pyridazin-6-one|5-Chlo...SMILES: CC1=C(C=NNC1=O)ClInChIKey: KFYSTBCKLBQPON-UHFFFAOYSA-NInChI: InChI=1S/C5H5ClN2O/c1-3-4(6)2-7-8-5(3)9/h2H,1H3,(H,8,9)
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4-n-Propylbiphenyl
Cas Number: 10289-45-9Formula: C15H16Molecular weight: 196.29Synonyms: 4-Propylbiphenyl|4-Propyl-1,1'-biphenyl|10289-45-9|4-n-Propylbiphenyl|71294-42-3|1-phenyl-4-propylbe...SMILES: CCCC1=CC=C(C=C1)C2=CC=CC=C2InChIKey: NAYIXKXYHOLMRC-UHFFFAOYSA-NInChI: InChI=1S/C15H16/c1-2-6-13-9-11-15(12-10-13)14-7-4-3-5-8-14/h3-5,7-12H,2,6H2,1H3
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2,5,6-trichloro-3-methyl-3,4-dihydropyrimidin-4-one
Cas Number: 1821308-45-5Formula: C5H3Cl3N2OMolecular weight: 213.44Synonyms: 2,5,6-Trichloro-3-methylpyrimidin-4(3H)-one | 1821308-45-5 | 2,5,6-trichloro-3-methyl-3,4-dihydropyr...SMILES: CN1C(=O)C(=C(N=C1Cl)Cl)ClInChIKey: QYISNYYGONBDTR-UHFFFAOYSA-NInChI: InChI=1S/C5H3Cl3N2O/c1-10-4(11)2(6)3(7)9-5(10)8/h1H3
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2-(4-Bromo-3,5-dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Cas Number: 942069-45-6Formula: C12H14BBrCl2O2Molecular weight: 351.9Synonyms: 2-(4-BROMO-3,5-DICHLOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE|942069-45-6|SCHEMBL14956695|D...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)Cl)Br)ClInChIKey: UKPPGPXWYPWLLX-UHFFFAOYSA-NInChI: InChI=1S/C12H14BBrCl2O2/c1-11(2)12(3,4)18-13(17-11)7-5-8(15)10(14)9(16)6-7/h5-6H,1-4H3
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TCO-PEG12-DBCO
Cas Number: 2055022-06-3Formula: C54H81N3O16Molecular weight: 1028.30Synonyms: DBCO-PEG12-TCO | 45-(11,12-Didehydrodibenz[b,f]azocin-5(6H)-yl)-41,45-dioxo-5,8,11,14,17,20,23,26,29...
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HEPES
Formula: C8H18N2O4SMolecular weight: 238.30Synonyms: HEPES|7365-45-9|2-(4-(2-Hydroxyethyl)piperazin-1-yl)ethanesulfonic acid|4-(2-Hydroxyethyl)-1-piperaz...SMILES: C1CN(CCN1CCO)CCS(=O)(=O)OInChIKey: JKMHFZQWWAIEOD-UHFFFAOYSA-NInChI: InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
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3-(1H-Pyrazol-4-yl)aniline
Cas Number: 1170691-45-8Formula: C9H9N3Molecular weight: 159.18Synonyms: 3-(4-Pyrazolyl)aniline | VWB69145 | A1-20411 | FT-0769611 | SY147622 | Z1124713455 | 3-(1H-pyrazol-4...SMILES: C1=CC(=CC(=C1)N)C2=CNN=C2InChIKey: MSVASNFGSQCRCN-UHFFFAOYSA-NInChI: InChI=1S/C9H9N3/c10-9-3-1-2-7(4-9)8-5-11-12-6-8/h1-6H,10H2,(H,11,12)
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5-Methyl-3-phenylisoxazole-4-carboxylic acid
Formula: C11H9NO3Molecular weight: 203.19Synonyms: 5-methyl-3-phenylisoxazole-4-carboxlic acid | 4-Isoxazolecarboxylic acid, 5-methyl-3-phenyl- | 5-met...SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OInChIKey: PENHKTNQUJMHIR-UHFFFAOYSA-NInChI: InChI=1S/C11H9NO3/c1-7-9(11(13)14)10(12-15-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)
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Ibuprofen piconol
Cas Number: 64622-45-3Formula: C19H23NO2Molecular weight: 297.39Synonyms: ibuprofen piconol|64622-45-3|Pimeprofen|Staderm|IBUPROFENPICONOL|Vesicum|112017-99-9|pyridin-2-ylmet...SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)OCC2=CC=CC=N2InChIKey: ACEWLPOYLGNNHV-UHFFFAOYSA-NInChI: InChI=1S/C19H23NO2/c1-14(2)12-16-7-9-17(10-8-16)15(3)19(21)22-13-18-6-4-5-11-20-18/h4-11,14-15H,12-13H2,1-3H3
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4-(3-Cyano-2-fluorophenyl)phenol
Cas Number: 1261951-45-4Formula: C13H8FNOMolecular weight: 213.2Synonyms: 1261951-45-4|2-Fluoro-4'-hydroxy-[1,1'-biphenyl]-3-carbonitrile|4-(3-CYANO-2-FLUOROPHENYL)PHENOL|2-f...SMILES: C1=CC(=C(C(=C1)C2=CC=C(C=C2)O)F)C#NInChIKey: XEXWPWIUOVCEIJ-UHFFFAOYSA-NInChI: InChI=1S/C13H8FNO/c14-13-10(8-15)2-1-3-12(13)9-4-6-11(16)7-5-9/h1-7,16H
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4-[2-(2-Hydroxyethoxy)ethyl]morpholine
Cas Number: 3603-45-0Formula: C8H17NO3Molecular weight: 175.225Synonyms: 4-[2-(2-Hydroxyethoxy)ethyl]morpholine|3603-45-0|2-(2-morpholin-4-ylethoxy)ethanol|2-(2-morpholinoet...SMILES: C1COCCN1CCOCCOInChIKey: BLIMWOGCOCPQEU-UHFFFAOYSA-NInChI: InChI=1S/C8H17NO3/c10-4-8-12-7-3-9-1-5-11-6-2-9/h10H,1-8H2
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