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Search results for: '53398-80-4'
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(4-methoxycarbonyl-2,6-dimethyl-phenyl) acridine-9-carboxylate
Cas Number: 1156506-80-7Formula: C24H19NO4Molecular weight: 385.41Synonyms: 1156506-80-7 | 4-(Methoxycarbonyl)-2,6-dimethylphenyl acridine-9-carboxylate | (4-methoxycarbonyl-2,...SMILES: CC1=CC(=CC(=C1OC(=O)C2=C3C=CC=CC3=NC4=CC=CC=C42)C)C(=O)OCInChIKey: DOUHCXDGBDELMK-UHFFFAOYSA-NInChI: InChI=1S/C24H19NO4/c1-14-12-16(23(26)28-3)13-15(2)22(14)29-24(27)21-17-8-4-6-10-19(17)25-20-11-7-5-9-18(20)21/h4-13H,1-3H3
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Sulfacetamide
Formula: C8H10N2O3SMolecular weight: 214.24Synonyms: sulfacetamide|144-80-9|Sulphacetamide|Acetosulfamine|N-((4-Aminophenyl)sulfonyl)acetamide|N-Acetylsu...SMILES: CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NInChIKey: SKIVFJLNDNKQPD-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2O3S/c1-6(11)10-14(12,13)8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)
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4-bromo-1H-indazole-3-carboxylic acid
Cas Number: 885521-80-2Formula: C8H5BrN2O2Molecular weight: 241.044Synonyms: 4-bromo-1H-indazole-3-carboxylic acid|885521-80-2|4-Bromo-3-indazolecarboxylic acid|MFCD07367963|Mon...SMILES: C1=CC2=C(C(=C1)Br)C(=NN2)C(=O)OInChIKey: IQVZPISNPRYBGH-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrN2O2/c9-4-2-1-3-5-6(4)7(8(12)13)11-10-5/h1-3H,(H,10,11)(H,12,13)
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4,4′-Diaminodiphenyl ether
Formula: C12H12N2OMolecular weight: 200.24Synonyms: 4,4'-Oxydianiline|101-80-4|4,4'-Diaminodiphenyl ether|4,4-Oxydianiline|4-Aminophenyl ether|4-(4-amin...SMILES: C1=CC(=CC=C1N)OC2=CC=C(C=C2)NInChIKey: HLBLWEWZXPIGSM-UHFFFAOYSA-NInChI: InChI=1S/C12H12N2O/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2
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4-benzylmorpholine-2-carboxylic acid
Cas Number: 769087-80-1Formula: C12H15NO3Molecular weight: 221.256Synonyms: 4-benzylmorpholine-2-carboxylic acid|769087-80-1|4-Benzyl-morpholine-2-carboxylic acid|MFCD06410628|...SMILES: C1COC(CN1CC2=CC=CC=C2)C(=O)OInChIKey: UJDWIUOGWSDEFP-UHFFFAOYSA-NInChI: InChI=1S/C12H15NO3/c14-12(15)11-9-13(6-7-16-11)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,14,15)
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tert-butyl N-(4-cyano-1-bicyclo[2.2.2]octanyl)carbamate
Cas Number: 2390512-80-6Formula: C14H22N2O2Molecular weight: 250.34Synonyms: 2390512-80-6 | SCHEMBL23879651 | F89830 | EN300-37396883 | tert-butyl N-{4-cyanobicyclo[2.2.2]octan-...SMILES: CC(C)(C)OC(=O)NC12CCC(CC1)(CC2)C#NInChIKey: KUHJHQSFJGTCPM-UHFFFAOYSA-NInChI: InChI=1S/C14H22N2O2/c1-12(2,3)18-11(17)16-14-7-4-13(10-15,5-8-14)6-9-14/h4-9H2,1-3H3,(H,16,17)
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(4-Isobutylphenyl)(4-methylphenyl)iodonium Hexafluorophosphate (ca. 70% in Propylene Carbonate)
Cas Number: 344562-80-7Formula: C17H20F6IPMolecular weight: 496.21Synonyms: 344562-80-7|Iodonium, (4-methylphenyl)[4-(2-methylpropyl)phenyl]-, hexafluorophosphate(1-)|(4-Isobut...SMILES: CC1=CC=C(C=C1)[I+]C2=CC=C(C=C2)CC(C)C.F[P-](F)(F)(F)(F)FInChIKey: YNDYCGZWQZEBCS-UHFFFAOYSA-NInChI: InChI=1S/C17H20I.F6P/c1-13(2)12-15-6-10-17(11-7-15)18-16-8-4-14(3)5-9-16;1-7(2,3,4,5)6/h4-11,13H,12H2,1-3H3;/q+1;-1
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Sulfachloropyridazine
Formula: C10H9ClN4O2SMolecular weight: 284.72Synonyms: Sulfachloropyridazine|sulfachlorpyridazine|80-32-0|4-amino-N-(6-chloropyridazin-3-yl)benzenesulfonam...SMILES: C1=CC(=CC=C1N)S(=O)(=O)NC2=NN=C(C=C2)ClInChIKey: XOXHILFPRYWFOD-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)
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Perhydrobisphenol A
Formula: (CH3)2C(C6H10OH)2Molecular weight: 240.38Synonyms: 80-04-6|4,4'-Isopropylidenedicyclohexanol|Perhydrobisphenol A|HBPA|2,2-Bis(4-hydroxycyclohexyl)propa...SMILES: CC(C)(C1CCC(CC1)O)C2CCC(CC2)OInChIKey: CDBAMNGURPMUTG-UHFFFAOYSA-NInChI: InChI=1S/C15H28O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h11-14,16-17H,3-10H2,1-2H3
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Sodium 4-fluorobenzenesulfinate
Cas Number: 824-80-6Formula: C6H4FNaO2SMolecular weight: 182.15Synonyms: Sodium 4-fluorobenzenesulfinate|824-80-6|4-Fluorobenzenesulfinic acid sodium salt|sodium;4-fluoroben...SMILES: C1=CC(=CC=C1F)S(=O)[O-].[Na+]InChIKey: VDDUCRSPMBZLMH-UHFFFAOYSA-MInChI: InChI=1S/C6H5FO2S.Na/c7-5-1-3-6(4-2-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1
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4-Ethyloctanoic acid
Cas Number: 16493-80-4 EC Number: 240-560-5Formula: C10H20O2Molecular weight: 172.26Synonyms: 4-Ethyloctanoic acid|16493-80-4|Octanoic acid, 4-ethyl-|4-Ethylcaprylic acid|F9ESD8LYSQ|MFCD00506494...SMILES: CCCCC(CC)CCC(=O)OInChIKey: PWKJMPFEQOHBAC-UHFFFAOYSA-NInChI: InChI=1S/C10H20O2/c1-3-5-6-9(4-2)7-8-10(11)12/h9H,3-8H2,1-2H3,(H,11,12)
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3',4'-Dichloro[1,1'-biphenyl]-4-sulfonyl chloride
Cas Number: 501697-80-9Formula: C12H7Cl3O2SMolecular weight: 321.6Synonyms: 501697-80-9|3',4'-dichloro[1,1'-biphenyl]-4-sulfonyl chloride|4-(3,4-dichlorophenyl)benzenesulfonyl ...SMILES: C1=CC(=CC=C1C2=CC(=C(C=C2)Cl)Cl)S(=O)(=O)ClInChIKey: DHVBZUPMGVOIOH-UHFFFAOYSA-NInChI: InChI=1S/C12H7Cl3O2S/c13-11-6-3-9(7-12(11)14)8-1-4-10(5-2-8)18(15,16)17/h1-7H
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4-Bromo-2-(trifluoromethoxy)benzaldehyde
Cas Number: 220996-80-5Formula: C8H4BrF3O2Molecular weight: 269Synonyms: 4-Bromo-2-(trifluoromethoxy)benzaldehyde|220996-80-5|4-bromo-2-trifluoromethoxy-benzaldehyde|4-Bromo...SMILES: C1=CC(=C(C=C1Br)OC(F)(F)F)C=OInChIKey: AXZVKHIUQLEMPJ-UHFFFAOYSA-NInChI: InChI=1S/C8H4BrF3O2/c9-6-2-1-5(4-13)7(3-6)14-8(10,11)12/h1-4H
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1-(cyanomethyl)cyclobutane-1-carboxylic acid
Cas Number: 1773507-80-4Formula: C7H9NO2Molecular weight: 139.15Synonyms: 1-(Cyanomethyl)cyclobutane-1-carboxylic acid | 1773507-80-4 | SCHEMBL16700278 | MFCD30152128 | SB225...SMILES: C1CC(C1)(CC#N)C(=O)OInChIKey: LZDGRSPFCNYUQU-UHFFFAOYSA-NInChI: InChI=1S/C7H9NO2/c8-5-4-7(6(9)10)2-1-3-7/h1-4H2,(H,9,10)
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3-(4-bromobenzoyl)azetidine hydrochloride
Cas Number: 1864074-80-5Formula: C10H11BrClNOSynonyms: 1864074-80-5 | 3-(4-bromobenzoyl)azetidine hydrochloride | 3-(4-Bromobenzoyl)azetidine HCl | azetidi...SMILES: C1C(CN1)C(=O)C2=CC=C(C=C2)Br.ClInChIKey: RBOBLVAZCZRKNO-UHFFFAOYSA-NInChI: InChI=1S/C10H10BrNO.ClH/c11-9-3-1-7(2-4-9)10(13)8-5-12-6-8;/h1-4,8,12H,5-6H2;1H
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4-(4-Chlorophenyl)cyclohexanone
Cas Number: 14472-80-1Formula: C12H13ClOMolecular weight: 208.68Synonyms: 4-(4-Chlorophenyl)cyclohexanone|14472-80-1|4-(4-chlorophenyl)cyclohexan-1-one|Cyclohexanone, 4-(4-ch...SMILES: C1CC(=O)CCC1C2=CC=C(C=C2)ClInChIKey: JNBOVWFOTNYTES-UHFFFAOYSA-NInChI: InChI=1S/C12H13ClO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-2,5-6,10H,3-4,7-8H2
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3-Fluoro-4-(methylthio)phenylboronic acid
Cas Number: 221030-80-4Formula: C7H8BFO2SMolecular weight: 186Synonyms: 3-Fluoro-4-(methylthio)phenylboronic acid|221030-80-4|(3-Fluoro-4-(methylthio)phenyl)boronic acid|(3...SMILES: B(C1=CC(=C(C=C1)SC)F)(O)OInChIKey: CNDNUZUKUGDDGL-UHFFFAOYSA-NInChI: InChI=1S/C7H8BFO2S/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,10-11H,1H3
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4-Bromo-7-methyl-2,1,3-benzothiadiazole
Cas Number: 2255-80-3Formula: C7H5BrN2SMolecular weight: 229.10Synonyms: 2255-80-3|4-Bromo-7-methylbenzo[c][1,2,5]thiadiazole|4-bromo-7-methyl-2,1,3-benzothiadiazole|4-BROMO...SMILES: CC1=CC=C(C2=NSN=C12)BrInChIKey: MZFRKYXVQYNOFA-UHFFFAOYSA-NInChI: InChI=1S/C7H5BrN2S/c1-4-2-3-5(8)7-6(4)9-11-10-7/h2-3H,1H3
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3-(1H-Indol-4-yl)benzoic acid
Cas Number: 442562-80-3Formula: C15H11NO2Molecular weight: 237.3Synonyms: 3-(1H-Indol-4-yl)benzoic acid|442562-80-3|3-(1H-Indol-4-yl)benzoicacid|3-(1H-indol-4-yl)-benzoic aci...SMILES: C1=CC(=CC(=C1)C(=O)O)C2=C3C=CNC3=CC=C2InChIKey: JIDDTZCMXFNWAB-UHFFFAOYSA-NInChI: InChI=1S/C15H11NO2/c17-15(18)11-4-1-3-10(9-11)12-5-2-6-14-13(12)7-8-16-14/h1-9,16H,(H,17,18)
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1-Chloro-2,3-difluoro-4-nitrobenzene
Cas Number: 169468-80-8Formula: C6H2ClF2NO2Molecular weight: 193.54Synonyms: 1-Chloro-2,3-difluoro-4-nitrobenzene|169468-80-8|4-Chloro-2,3-difluoronitrobenzene|4-Chloro-2, 3-dif...SMILES: C1=CC(=C(C(=C1[N+](=O)[O-])F)F)ClInChIKey: OFQRRFRIDGZHSC-UHFFFAOYSA-NInChI: InChI=1S/C6H2ClF2NO2/c7-3-1-2-4(10(11)12)6(9)5(3)8/h1-2H
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Halazone
Cas Number: 80-13-7Formula: C7H5Cl2NO4SMolecular weight: 270.08Synonyms: halazone|80-13-7|Halazon|Pantocid|Cloritines|4-(Dichlorosulfamoyl)benzoic Acid|Pantocide|Pantosid|Pa...SMILES: C1=CC(=CC=C1C(=O)O)S(=O)(=O)N(Cl)ClInChIKey: XPDVQPODLRGWPL-UHFFFAOYSA-NInChI: InChI=1S/C7H5Cl2NO4S/c8-10(9)15(13,14)6-3-1-5(2-4-6)7(11)12/h1-4H,(H,11,12)
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4-Methyl-2,3,4,5-tetrahydropyridin-6-amine
Cas Number: 165383-71-1Formula: C6H12N2Molecular weight: 112.17Synonyms: 2-imino-4-methylpiperidine | 4-methyl-2,3,4,5-tetrahydropyridin-6-amine | 4-Methyl-piperidin-(2E)-yl...SMILES: CC1CCN=C(C1)NInChIKey: GGDLOMFAKKVDPT-UHFFFAOYSA-NInChI: InChI=1S/C6H12N2/c1-5-2-3-8-6(7)4-5/h5H,2-4H2,1H3,(H2,7,8)
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4,4'-Diaminodiphenyl Sulfone(DDS)
Formula: C12H12N2O2SMolecular weight: 248.3Synonyms: dapsone|80-08-0|4,4'-Sulfonyldianiline|4,4'-Diaminodiphenyl sulfone|Diaphenylsulfone|4,4'-Diaminodip...SMILES: C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)NInChIKey: MQJKPEGWNLWLTK-UHFFFAOYSA-NInChI: InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2
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4-Amino-6-morpholinopyrimidine
Cas Number: 96225-80-8Formula: C8H12N4OMolecular weight: 180.2Synonyms: 96225-80-8|4-AMINO-6-MORPHOLINOPYRIMIDINE|6-morpholinopyrimidin-4-amine|6-(morpholin-4-yl)pyrimidin-...SMILES: C1COCCN1C2=NC=NC(=C2)NInChIKey: XQOJWZMBGGYWCA-UHFFFAOYSA-NInChI: InChI=1S/C8H12N4O/c9-7-5-8(11-6-10-7)12-1-3-13-4-2-12/h5-6H,1-4H2,(H2,9,10,11)
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