Benzenoids

alpha,alpha'-Dichloro-o-xylene, 98%

2-[(4-Methylpiperazin-1-yl)methyl]benzonitrile, ≥97%, Thermo Scientific™

CAS: 864069-00-1 Molecular Formula: C13H17N3 Molecular Weight (g/mol): 215.3 MDL Number: MFCD08271956 InChI Key: SZENQRLSNAOEPP-UHFFFAOYSA-N Synonym: 2-4-methylpiperazin-1-yl methyl benzonitrile,benzonitrile,2-4-methyl-1-piperazinyl methyl,2-4-methylpiperazinyl methyl benzenecarbonitrile PubChem CID: 18525814 IUPAC Name: 2-[(4-methylpiperazin-1-yl)methyl]benzonitrile SMILES: CN1CCN(CC1)CC2=CC=CC=C2C#N

2-Methoxy-4-methylphenol, 99%

CAS: 93-51-6 Molecular Formula: C₈H₁₀O₂ Molecular Weight (g/mol): 138.17 MDL Number: MFCD00002378 InChI Key: PETRWTHZSKVLRE-UHFFFAOYSA-N Synonym: creosol,4-methylguaiacol,2-methoxy-p-cresol,homoguaiacol,p-methylguaiacol,phenol, 2-methoxy-4-methyl,p-creosol,4-methyl guaiacol,2-methoxy-4-cresol,4-hydroxy-3-methoxytoluene PubChem CID: 7144 IUPAC Name: 2-methoxy-4-methylphenol SMILES: CC1=CC(=C(C=C1)O)OC

2,3-Difluorophenol, 98+%

CAS: 6418-38-8 Molecular Formula: C6H4F2O Molecular Weight (g/mol): 130.094 MDL Number: MFCD00010262 InChI Key: RPEPGIOVXBBUMJ-UHFFFAOYSA-N Synonym: phenol, 2,3-difluoro,phenol, difluoro,2,3-difluoro phenol,difluorophenol,difluoro-phenol,2.3-difluorophenol,2,3-difluoro-phenol,pubchem1494,acmc-1b6pt,2,3-bis fluoranyl phenol PubChem CID: 80879 IUPAC Name: 2,3-difluorophenol SMILES: C1=CC(=C(C(=C1)F)F)O

4-Nitrobenzenesulfonamide, 97%

CAS: 6325-93-5 Molecular Formula: C6H6N2O4S Molecular Weight (g/mol): 202.18 MDL Number: MFCD00007937 InChI Key: QWKKYJLAUWFPDB-UHFFFAOYSA-N Synonym: benzenesulfonamide, 4-nitro,p-nitrobenzenesulfonamide,4-nitrobenzolesulfamide,p-nitrophenylsulfonamide,4-nitrobenzenesulphonamide,benzenesulfonamide, p-nitro,4-nitro-benzenesulfonamide,unii-tuf52o8y8b,tuf52o8y8b,4-nitrobenzene-1-sulfonamide PubChem CID: 22784 IUPAC Name: 4-nitrobenzenesulfonamide SMILES: NS(=O)(=O)C1=CC=C(C=C1)[N+]([O-])=O

1,3,6-Naphthalenetrisulfonic acid, sodium salt hydrate, 75%, mixture of isomers

CAS: 19437-42-4 Molecular Formula: C10H5Na3O9S3 Molecular Weight (g/mol): 434.29 MDL Number: MFCD00149263 MFCD00003989 InChI Key: NJPKYOIXTSGVAN-UHFFFAOYSA-K Synonym: 1,3,6-naphthalenetrisulfonic acid, sodium salt,1,3,6-naphthalenetrisulfonic acid, sodium salt 1:? PubChem CID: 73555608 IUPAC Name: sodium;5,7-disulfonaphthalene-2-sulfonate SMILES: [Na+].[Na+].[Na+].[O-]S(=O)(=O)C1=CC2=CC(=CC(=C2C=C1)S([O-])(=O)=O)S([O-])(=O)=O

4-Dimethylaminobenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1

2-Amino-5-bromobenzoic acid, 97%

CAS: 5794-88-7 Molecular Formula: C₇H₆BrNO₂ Molecular Weight (g/mol): 216.03 MDL Number: MFCD00007823 InChI Key: CUKXRHLWPSBCTI-UHFFFAOYSA-N Synonym: 5-bromoanthranilic acid,benzoic acid, 2-amino-5-bromo,anthranilic acid, 5-bromo,2-amino-5-bromo-benzoic acid,5-bromo-2-aminobenzoic acid,2-amino-5-bromobenzoicacid,2-amino-5-bromo benzoic acid,5-bromo anthranilic acid,buttpark 89\07-49,5-bromo-2-amino-benzoic acid PubChem CID: 79858 IUPAC Name: 2-amino-5-bromobenzoic acid SMILES: C1=CC(=C(C=C1Br)C(=O)O)N

2-Acetamidophenol, 97%

CAS: 614-80-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002181 InChI Key: ADVGKWPZRIDURE-UHFFFAOYSA-N Synonym: 2-acetamidophenol,n-2-hydroxyphenyl acetamide,2'-hydroxyacetanilide,o-hydroxyacetanilide,2-acetaminophenol,2-hydroxyacetanilide,o-acetamidophenol,o-acetylamino phenol,2-acetylamino phenol,o-acetaminophenol PubChem CID: 11972 IUPAC Name: N-(2-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=CC=C1O

2-Chloro-6-nitro-4-(trifluoromethyl)aniline, 97%

CAS: 57729-79-0 Molecular Formula: C7H4ClF3N2O2 Molecular Weight (g/mol): 240.566 MDL Number: MFCD00042153 InChI Key: JLWRJMVXRUKFPA-UHFFFAOYSA-N Synonym: 2-chloro-6-nitro-4-trifluoromethyl aniline,4-amino-3-chloro-5-nitrobenzotrifluoride,6-chloro-2-nitro-4-trifluoromethyl phenylamine,pubchem2811,2-chloro-4-trifluoromethyl-6-nitroaniline,4-amino-3-chloro-5-nitro-benzotrifluoride,2-chloranyl-6-nitro-4-trifluoromethyl aniline,2-chloro-6-nitro-4-trifluoromethyl-phenylamine,2-chloro-6-nitro-4-trifluoromethyl phenylamine PubChem CID: 2734081 IUPAC Name: 2-chloro-6-nitro-4-(trifluoromethyl)aniline SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])N)Cl)C(F)(F)F

1-tert-Butyl-3-ethylbenzene, 98%

CAS: 14411-56-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00060845 InChI Key: MUJPTTGNHRHIPH-UHFFFAOYSA-N PubChem CID: 139753 IUPAC Name: 1-tert-butyl-3-ethylbenzene SMILES: CCC1=CC(=CC=C1)C(C)(C)C

4-Chloro-3-(trifluoromethyl)phenyl isocyanate, 97%

CAS: 327-78-6 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.563 MDL Number: MFCD00013874 InChI Key: NBJZEUQTGLSUOB-UHFFFAOYSA-N Synonym: 4-chloro-3-trifluoromethyl phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl phenylisocyanate,benzene, 1-chloro-4-isocyanato-2-trifluoromethyl,4-chloro-3-trifluoromethylphenyl isocyanate,4-chloro-3-trifluoromethoxy phenyl isocyanate,1-chloro-4-isocyanato-2-trifluoromethyl-benzene,4-chloro-3-trifluoromethyl benzenisocyanate,3-trifluoromethyl-4-chloro-phenyl isocyanate,pubchem5027 PubChem CID: 2733265 IUPAC Name: 1-chloro-4-isocyanato-2-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1N=C=O)C(F)(F)F)Cl

Ethyl salicylate, 99%

CAS: 118-61-6 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002215 InChI Key: GYCKQBWUSACYIF-UHFFFAOYSA-N Synonym: ethyl salicylate,sal ethyl,mesotol,salotan,salicylic ether,salicylic acid, ethyl ester,benzoic acid, 2-hydroxy-, ethyl ester,ethyl o-hydroxybenzoate,o-ethoxycarbonyl phenol,2-hydroxybenzoic acid ethyl ester PubChem CID: 8365 IUPAC Name: ethyl 2-hydroxybenzoate SMILES: CCOC(=O)C1=CC=CC=C1O

2,4-Difluorobenzoyl chloride, 97%

CAS: 72482-64-5 Molecular Formula: C7H3ClF2O Molecular Weight (g/mol): 176.55 MDL Number: MFCD00000658 InChI Key: JSWRVDNTKPAJLB-UHFFFAOYSA-N PubChem CID: 588081 IUPAC Name: 2,4-difluorobenzoyl chloride SMILES: FC1=CC=C(C(Cl)=O)C(F)=C1

2,4-Dinitrobenzenesulfonic acid sodium salt, 97%

CAS: 885-62-1 Molecular Formula: C6H3N2NaO7S Molecular Weight (g/mol): 270.15 MDL Number: MFCD00007471,MFCD10567393 InChI Key: GSBYVRKLPCSLNV-UHFFFAOYSA-M Synonym: sodium 2,4-dinitrobenzenesulfonate hydrate,acmc-209quh,sodium dnbs hydrate,2,4-dinitrobenzenesulfonic acid sodium salt hydrate PubChem CID: 70700115 IUPAC Name: sodium;2,4-dinitrobenzenesulfonate;hydrate SMILES: [Na+].[O-][N+](=O)C1=CC=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O