Benzenoids
3-Cyclopropylmethoxy-4-difluoromethoxybenzoic acid, 98%
CAS: 162401-62-9 Molecular Formula: C12H12F2O4 Molecular Weight (g/mol): 258.221 MDL Number: MFCD04621687 InChI Key: IGFDIFLMMLWKKY-UHFFFAOYSA-N Synonym: 3-cyclopropylmethoxy-4-difluoromethoxy benzoic acid,3-cyclopropylmethoxy-4-difluoromethoxy-benzoic acid,benzoic acid, 3-cyclopropylmethoxy-4-difluoromethoxy,roflumilast intermediate,roflumilast intermediate b,3-cyclopropylmethoxy-4-difluoromethoxybenzoicacid,3-cyclopropylmethoxy-4-difluoromethoxy-benzoic acid,3-cyclopropylmethoxy 4-difluoromethoxy benzoic acid PubChem CID: 2394006 IUPAC Name: 3-(cyclopropylmethoxy)-4-(difluoromethoxy)benzoic acid SMILES: C1CC1COC2=C(C=CC(=C2)C(=O)O)OC(F)F
4-Fluoro-2-methoxyphenol, 97%
CAS: 450-93-1 Molecular Formula: C7H7FO2 Molecular Weight (g/mol): 142.13 MDL Number: MFCD00070797 InChI Key: OULGLTLTWBZBLO-UHFFFAOYSA-N Synonym: 4-fluoroguaiacol,5-fluoro-2-hydroxyanisole,4-fluoro-2-methoxy-phenol,phenol, 4-fluoro-2-methoxy,4-fluoro-2-methyoxyphenol,pubchem3880,acmc-1agod,2-methoxy-4-fluorophenol,4-fluoro-2-methoxyphenol PubChem CID: 2737368 IUPAC Name: 4-fluoro-2-methoxyphenol SMILES: COC1=CC(F)=CC=C1O
2,3-Dichlorophenol, 98+%
CAS: 576-24-9 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163.00 MDL Number: MFCD00002160 InChI Key: UMPSXRYVXUPCOS-UHFFFAOYSA-N Synonym: phenol, 2,3-dichloro,dichlorophenol,unii-izm39u444l,ccris 5902,2,3-dichloro phenol,2,3 dichlorophenol,phenol,3-dichloro,pubchem3696,2,3-dichloro-phenol,acmc-1ar0l PubChem CID: 11334 IUPAC Name: 2,3-dichlorophenol SMILES: OC1=CC=CC(Cl)=C1Cl
4-Chloro-3-nitrobenzophenone, 99%
CAS: 56107-02-9 Molecular Formula: C13H8ClNO3 Molecular Weight (g/mol): 261.66 MDL Number: MFCD00007081 InChI Key: YBDBYPQFIMSFJW-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrobenzophenone,methanone, 4-chloro-3-nitrophenyl phenyl,benzophenone, 4-chloro-3-nitro,4-chloro-3-nitrophenyl phenyl methanone,3-nitro-4-chlorobenzophenone,chembl53270,4-chloro-3-nitrophenyl-phenylmethanone,4-chloro-3-nitro-phenyl-phenyl-methanone,4-chloro-3-nitrophenyl phenyl ketone,acmc-20amlb PubChem CID: 41743 IUPAC Name: (4-chloro-3-nitrophenyl)-phenylmethanone SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)C(=O)C1=CC=CC=C1
3-Bromostyrene, 97%, stab. with 0.1% 4-tert-butylcatechol
CAS: 2039-86-3 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.048 MDL Number: MFCD00000088 InChI Key: KQJQPCJDKBKSLV-UHFFFAOYSA-N Synonym: 3-bromostyrene,1-bromo-3-vinylbenzene,m-bromostyrene,benzene, 1-bromo-3-ethenyl,1-bromo-3-vinyl-benzene,unii-6xe3sf241y,3-bromo-styrene,pubchem23859,acmc-1cmdc,1-bromo-3-vinylbenzene # PubChem CID: 74870 IUPAC Name: 1-bromo-3-ethenylbenzene SMILES: C=CC1=CC(=CC=C1)Br
2,4-Dimethoxybenzonitrile, 99%
CAS: 4107-65-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00001786 InChI Key: RYRZSQQELLQCMZ-UHFFFAOYSA-N Synonym: benzonitrile, 2,4-dimethoxy,2,4-dimethoxy-benzonitrile,2,4-dimethoxybenzenecarbonitrile,pubchem13105,acmc-1anqc,2.4-dimethoxybenzonitril,ksc497m9f,2,4-dimethoxybenzonitrile PubChem CID: 77750 IUPAC Name: 2,4-dimethoxybenzonitrile SMILES: COC1=CC(=C(C=C1)C#N)OC
2,3,5,6-Tetrafluoroanisole, 97%
CAS: 2324-98-3 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00000311 InChI Key: AXCOCGJDERQVDK-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole PubChem CID: 75351 IUPAC Name: 1,2,4,5-tetrafluoro-3-methoxybenzene SMILES: COC1=C(F)C(F)=CC(F)=C1F
Iodosobenzene diacetate, 98+%
CAS: 3240-34-4 Molecular Formula: C10H11IO4 Molecular Weight (g/mol): 322.098 MDL Number: MFCD00008692 InChI Key: ZBIKORITPGTTGI-UHFFFAOYSA-N Synonym: iodobenzene diacetate,diacetoxyiodo benzene,iodosobenzene diacetate,phenyliodine diacetate,phenyliodo diacetate,phenyliodoso acetate,phenyliodosodiacetate,phenyliodoso diacetate,bis acetato phenyliodine,benzene, diacetoxyiodo PubChem CID: 76724 IUPAC Name: [acetyloxy(phenyl)-$l^{3}-iodanyl] acetate SMILES: CC(=O)OI(C1=CC=CC=C1)OC(=O)C
2-Amino-3-methylbenzoic acid, 98%
CAS: 4389-45-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00007745 InChI Key: WNAJXPYVTFYEST-UHFFFAOYSA-N Synonym: 3-methylanthranilic acid,2-amino-3-methyl-benzoic acid,2-amino-3-methylbenzoicacid,3-methyl-2-aminobenzoic acid,benzoic acid, 2-amino-3-methyl,2-amino-m-toluic acid,2-amino-3-methyl benzoic acid,m-toluic acid, 2-amino,unii-8rgx6sqe9n,2-amino-3-methylbenzoate PubChem CID: 78101 ChEBI: CHEBI:80574 IUPAC Name: 2-amino-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1N)C(=O)O
Di-n-propyl phthalate, 98%
CAS: 131-16-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009371 InChI Key: MQHNKCZKNAJROC-UHFFFAOYSA-N Synonym: dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss PubChem CID: 8559 ChEBI: CHEBI:60069 IUPAC Name: dipropyl benzene-1,2-dicarboxylate SMILES: CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 97%
CAS: 122-48-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00048232 InChI Key: OJYLAHXKWMRDGS-UHFFFAOYSA-N Synonym: zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl PubChem CID: 31211 ChEBI: CHEBI:68657 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC(=C(C=C1)O)OC
Methyl 4-fluoro-3-hydroxybenzoate, 98+%
CAS: 214822-96-5 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.139 MDL Number: MFCD06797457 InChI Key: CUGWNEOTLGLGDG-UHFFFAOYSA-N Synonym: 4-fluoro-3-hydroxybenzoic acid methyl ester,benzoic acid, 4-fluoro-3-hydroxy-, methyl ester,pubchem3567,acmc-209fky,methyl4-fluoro-3-hydroxybenzoate,methyl 4-fluoranyl-3-oxidanyl-benzoate,3-hydroxy-4-fluorobenzoic acid methyl ester,4-fluoro-3-hydroxy-benzoic acid methyl ester,benzoic acid,4-fluoro-3-hydroxy-, methyl ester PubChem CID: 12016892 IUPAC Name: methyl 4-fluoro-3-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C=C1)F)O
1-Bromo-3-n-hexylbenzene, 97+%
CAS: 38409-59-5 Molecular Formula: C12H17Br Molecular Weight (g/mol): 241.172 MDL Number: MFCD09909567 InChI Key: HZUVRCRPECDFAT-UHFFFAOYSA-N Synonym: 1-bromo-3-n-hexylbenzene,1-bromo-3-hexyl-benzene,3-hexylbromobenzene,3-n-hexyl bromobenzene,#,benzene, 1-bromo-3-hexyl PubChem CID: 563022 IUPAC Name: 1-bromo-3-hexylbenzene SMILES: CCCCCCC1=CC(=CC=C1)Br
3,6-Difluorophthalic acid, 98%, Thermo Scientific Chemicals
CAS: 651-97-8 Molecular Formula: C8H4F2O4 Molecular Weight (g/mol): 202.113 MDL Number: MFCD03840499 InChI Key: VFLMWMTWWZGXGA-UHFFFAOYSA-N Synonym: 3,6-difluorobenzene-1,2-dicarboxylic acid,1,4-difluorophthalic acid,3,6-difluorophthalicacid,pubchem1945,acmc-1ays1,3,6-difluoro-phthalic acid,ksc352e6d,3,5-difluoro-1,2-benzenedicarboxylic acid,1,2-benzenedicarboxylicacid, 3,6-difluoro PubChem CID: 643385 IUPAC Name: 3,6-difluorophthalic acid SMILES: C1=CC(=C(C(=C1F)C(=O)O)C(=O)O)F
Bis(p-toluenesulfonyl)methane, 97%
CAS: 15310-28-8 Molecular Formula: C15H16O4S2 Molecular Weight (g/mol): 324.41 MDL Number: MFCD00032255 InChI Key: XLOXYWLRAKCDQL-UHFFFAOYSA-N Synonym: ditosylmethane,bis-toluene-4-sulfonyl-methane,1-methyl-4-4-methylbenzenesulfonyl methanesulfonyl benzene,1,1'-methanediyldisulfonyl bis 4-methylbenzene,acmc-20allu,bis p-tolylsulfonyl methane,bis p-toluenesulfonyl methane,bis-toluene-4-sulfonyl methane,1,1'-methylenedisulfonyl bis 4-methylbenzene,benzene,1,1'-methylenebis sulfonyl bis 4-methyl PubChem CID: 275690 IUPAC Name: 1-methyl-4-[(4-methylphenyl)sulfonylmethylsulfonyl]benzene SMILES: CC1=CC=C(C=C1)S(=O)(=O)CS(=O)(=O)C1=CC=C(C)C=C1