Benzene and substituted derivatives

Rosolic acid, ACROS Organics™

CAS: 603-45-2 Molecular Formula: C19H14O3 Molecular Weight (g/mol): 290.32 MDL Number: MFCD00001624 InChI Key: FYEHYMARPSSOBO-UHFFFAOYSA-N Synonym: aurin, rosolic acid, corallin, p-rosolic acid, aurine, spirit aurine, corallin spirit soluble, 4,4'-dihydroxyfuchsone, aurin no. 555, 4-bis 4-hydroxyphenyl methylene cyclohexa-2,5-dienone PubChem CID: 5100 ChEBI: CHEBI:34544 IUPAC Name: 4-[bis(4-hydroxyphenyl)methylidene]cyclohexa-2,5-dien-1-one SMILES: C1=CC(=O)C=CC1=C(C2=CC=C(C=C2)O)C3=CC=C(C=C3)O

Dextran sulfate sodium salt (36,000-50,000 M.Wt), MP Grade, MP Biomedicals™

CAS: 9011-18-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 InChI Key: BLFLLBZGZJTVJG-UHFFFAOYSA-N Synonym: benzocaine, ethyl aminobenzoate, ethyl p-aminobenzoate, americaine, anesthesin, anaesthesin, ethoform, norcaine, orthesin, parathesin PubChem CID: 2337 ChEBI: CHEBI:116735 IUPAC Name: ethyl 4-aminobenzoate SMILES: CCOC(=O)C1=CC=C(C=C1)N

o-Toluidine, 99%, ACROS Organics™

CAS: 95-53-4 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.15 MDL Number: MFCD00007730 InChI Key: RNVCVTLRINQCPJ-UHFFFAOYSA-N Synonym: o-toluidine, 2-toluidine, o-tolylamine, 2-aminotoluene, 2-methylbenzenamine, ortho-toluidine, o-methylaniline, benzenamine, 2-methyl, o-aminotoluene, o-methylbenzenamine PubChem CID: 7242 ChEBI: CHEBI:66892 IUPAC Name: 2-methylaniline SMILES: CC1=CC=CC=C1N

Crystal Violet, pure, indicator, ACROS Organics™

CAS: 548-62-9 Molecular Formula: C25H30ClN3 Molecular Weight (g/mol): 407.986 MDL Number: MFCD00011750 InChI Key: ZXJXZNDDNMQXFV-UHFFFAOYSA-M Synonym: Basic Violet 3, C.I. 42555, Gentian Violet PubChem CID: 11057 ChEBI: CHEBI:41688 IUPAC Name: [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium;chloride SMILES: CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.[Cl-]

p-Toluenesulfonic acid monohydrate, ACS reagent, ACROS Organics™

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, 4-methylbenzenesulfonic acid monohydrate, p-toluene sulfonic acid monohydrate, unii-3bto78gaff, benzenesulfonic acid, 4-methyl-, monohydrate, ptoluenesulfonic acid, p-toluenesulfonic acid, monohydrate, 3bto78gaff, 4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

p-Toluenesulfonic acid monohydrate, 99%, extra pure, ACROS Organics™

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, 4-methylbenzenesulfonic acid monohydrate, p-toluene sulfonic acid monohydrate, unii-3bto78gaff, benzenesulfonic acid, 4-methyl-, monohydrate, ptoluenesulfonic acid, p-toluenesulfonic acid, monohydrate, 3bto78gaff, 4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

Toluene-4-Sulfonic Acid, Extra Pure, SLR, Fisher Chemical™

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: 142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, 4-methylbenzenesulfonic acid monohydrate, p-toluene sulfonic acid monohydrate, unii-3bto78gaff, benzenesulfonic acid, 4-methyl-, monohydrate, ptoluenesulfonic acid, p-toluenesulfonic acid, monohydrate, 3bto78gaff, 4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

Alfa Aesar™ p-Toluenesulfonic acid monohydrate, ACS, 98.5+%

CAS: 6192-52-5 Molecular Formula: C7H10O4S Molecular Weight (g/mol): 190.213 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, 4-methylbenzenesulfonic acid monohydrate, p-toluene sulfonic acid monohydrate, unii-3bto78gaff, benzenesulfonic acid, 4-methyl-, monohydrate, ptoluenesulfonic acid, p-toluenesulfonic acid, monohydrate, 3bto78gaff, 4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

Alfa Aesar™ (4-Carboxybutyl)triphenylphosphonium bromide, 98%

CAS: 17814-85-6 Molecular Formula: C23H24BrO2P Molecular Weight (g/mol): 443.321 MDL Number: MFCD00011906 InChI Key: MLOSJPZSZWUDSK-UHFFFAOYSA-N Synonym: 4-carboxybutyl triphenylphosphonium bromide, phosphonium, 4-carboxybutyl triphenyl-, bromide, 4-carboxybutyl triphenylphosphanium bromide, carboxybutyltriphenylphosphonium bromide, 5-triphenylphosphonio pentanoic acid bromide, 4-carboxybutyl-triphenylphosphonium bromide, triphenyl 4-carboxybutyl phosphonium bromide, 4-carboxybutyl triphenyl phosphonium bromide PubChem CID: 161236 IUPAC Name: 4-carboxybutyl(triphenyl)phosphanium;bromide SMILES: C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Chrome Azurol S, MP Biomedicals™

CAS: 1667-99-8 Molecular Formula: C23H13Cl2Na3O9S Molecular Weight (g/mol): 605.277 MDL Number: MFCD00001615 InChI Key: FUIZKNBTOOKONL-UHFFFAOYSA-K Synonym: Mordant Blue 29, C.I. 43825 PubChem CID: 54736314 IUPAC Name: trisodium;5-[(3-carboxy-5-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-(2,6-dichloro-3-sulfonatophenyl)methyl]-3-methyl-2-oxidobenzoate SMILES: CC1=CC(=CC(=C1[O-])C(=O)[O-])C(=C2C=C(C(=O)C(=C2)C(=O)O)C)C3=C(C=CC(=C3Cl)S(=O)(=O)[O-])Cl.[Na+].[Na+].[Na+]

Alfa Aesar™ 3-Bromo-4-methoxybiphenyl, 99%

CAS: 74447-73-7 Molecular Formula: C13H11BrO Molecular Weight (g/mol): 263.134 MDL Number: MFCD00079720 InChI Key: QJGJVVIDRMVQMR-UHFFFAOYSA-N Synonym: 3-bromo-4-methoxybiphenyl, 3-bromo-4-methoxy-1,1'-biphenyl, 2-bromo-1-methoxy-4-phenyl-menzene, acmc-20an8p, 2-bromo-4-phenylanisole, maybridge3_000975, 3-bromo-4-methoxy-biphenyl, 2-methoxy-5-phenyl-phenylbromide, 2-bromo-1-methoxy-4-phenyl-benzene PubChem CID: 262267 IUPAC Name: 2-bromo-1-methoxy-4-phenylbenzene SMILES: COC1=C(C=C(C=C1)C2=CC=CC=C2)Br

Alfa Aesar™ Octafluorotoluene, 98+%

CAS: 434-64-0 Molecular Formula: C7F8 Molecular Weight (g/mol): 236.064 MDL Number: MFCD00000375 InChI Key: USPWUOFNOTUBAD-UHFFFAOYSA-N Synonym: octafluorotoluene, perfluorotoluene, 1,2,3,4,5-pentafluoro-6-trifluoromethyl benzene, toluene, octafluoro, benzene, pentafluoro trifluoromethyl, trifluoromethyl pentafluorobenzene, pentafluorobenzotrifluoride, 1,2,3,4,5-pentafluoro-6-trifluoromethyl-benzene, benzene, 1,2,3,4,5-pentafluoro-6-trifluoromethyl, acmc-209juh PubChem CID: 9906 IUPAC Name: 1,2,3,4,5-pentafluoro-6-(trifluoromethyl)benzene SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)C(F)(F)F

p-Toluenesulfonic acid monohydrate, 97.5%, pure, ACROS Organics™

CAS: 6192-52-5 Molecular Formula: C7H8O3S·H2O Molecular Weight (g/mol): 190.22 MDL Number: MFCD00142137 InChI Key: KJIFKLIQANRMOU-UHFFFAOYSA-N Synonym: p-toluenesulfonic acid monohydrate, 4-methylbenzenesulfonic acid hydrate, 4-methylbenzenesulfonic acid monohydrate, p-toluene sulfonic acid monohydrate, unii-3bto78gaff, benzenesulfonic acid, 4-methyl-, monohydrate, ptoluenesulfonic acid, p-toluenesulfonic acid, monohydrate, 3bto78gaff, 4-methylbenzene-1-sulfonic acid hydrate PubChem CID: 521998 IUPAC Name: 4-methylbenzenesulfonic acid;hydrate SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.O

Alfa Aesar™ 1,3-Dibenzoylbenzene, 98+%

CAS: 3770-82-9 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00014086 InChI Key: MJQHDSIEDGPFAM-UHFFFAOYSA-N Synonym: 1,3-dibenzoylbenzene, 1,3-phenylenebis phenylmethanone, m-dibenzoylbenzene, methanone, 1,3-phenylenebis phenyl, 3-benzoylphenyl phenyl methanone, m-dibenzoyl benzene, methanone, 1,1'-1,3-phenylene bis 1-phenyl, phenyl 3-phenylcarbonyl phenyl ketone PubChem CID: 77388 IUPAC Name: (3-benzoylphenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)C(=O)C3=CC=CC=C3

Alfa Aesar™ 2-Aminobenzyl alcohol, 98%

CAS: 5344-90-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007749 InChI Key: VYFOAVADNIHPTR-UHFFFAOYSA-N Synonym: 2-aminobenzyl alcohol, 2-aminophenyl methanol, 2-aminobenzylalcohol, o-aminobenzyl alcohol, 2-aminobenzenemethanol, benzenemethanol, 2-amino, o-aminobenzylic alcohol, o-hydroxymethyl aniline, benzyl alcohol, o-amino, 2-hydroxymethylaniline PubChem CID: 21439 IUPAC Name: (2-aminophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)N

Alfa Aesar™ 2,3,4,5,6-Pentafluorobenzyl alcohol, 98%

CAS: 440-60-8 Molecular Formula: C7H3F5O Molecular Weight (g/mol): 198.092 MDL Number: MFCD00004602 InChI Key: PGJYYCIOYBZTPU-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorobenzyl alcohol, pentafluorobenzyl alcohol, perfluorophenyl methanol, pentafluorophenyl methanol, 2,3,4,5,6-pentafluorophenyl methanol, 2,3,4,5,6-pentafluorobenzenemethanol, hydroxymethyl pentafluorobenzene, benzenemethanol, 2,3,4,5,6-pentafluoro, pentafluorobenzylalcohol, 2,3,4,5,6-pentafluorobenzylalcohol PubChem CID: 9923 ChEBI: CHEBI:44903 IUPAC Name: (2,3,4,5,6-pentafluorophenyl)methanol SMILES: C(C1=C(C(=C(C(=C1F)F)F)F)F)O

4-Fluorobenzyl isocyanate, 98%, ACROS Organics™

CAS: 132740-43-3 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.15 MDL Number: MFCD00673062 InChI Key: HHSIWJYERNCLKQ-UHFFFAOYSA-N Synonym: 4-fluorobenzyl isocyanate, 1-fluoro-4-isocyanatomethyl benzene, 4-fluorobenzylisocyanate, 4-fluorophenyl methanisocyanate, 4-fluorobezylisocyanate, acmc-1c0to, intermediates-zcf02017, 4-fluoro benzyl isocyanate, 4-fluorophenyl methyl isocyanate PubChem CID: 2733376 IUPAC Name: 1-fluoro-4-(isocyanatomethyl)benzene SMILES: C1=CC(=CC=C1CN=C=O)F

Alfa Aesar™ Aluminon

CAS: 569-58-4 Molecular Formula: C22H23N3O9 Molecular Weight (g/mol): 473.438 MDL Number: MFCD00040925 InChI Key: AIPNSHNRCQOTRI-UHFFFAOYSA-N Synonym: Aurintricarboxylic acid triammonium salt PubChem CID: 54729869 ChEBI: CHEBI:87398 IUPAC Name: triazanium;5-[(3-carboxy-4-oxidophenyl)-(3-carboxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-oxidobenzoate SMILES: C1=CC(=C(C=C1C(=C2C=CC(=O)C(=C2)C(=O)O)C3=CC(=C(C=C3)[O-])C(=O)[O-])C(=O)O)[O-].[NH4+].[NH4+].[NH4+]

Alfa Aesar™ 3,3',5,5'-Tetramethylbenzidine soln., Ready-to-Use, standard sensitivity

CAS: 54827-17-7 Molecular Formula: C16H20N2 Molecular Weight (g/mol): 240.35 MDL Number: MFCD00007748 InChI Key: UAIUNKRWKOVEES-UHFFFAOYSA-N Synonym: 3,3',5,5'-tetramethylbenzidine, 3,3',5,5'-tetramethyl-1,1'-biphenyl-4,4'-diamine, 3,5,3',5'-tetramethylbenzidine, tmb, 3,3',5,5'-tetramethyl benzidine, tmb substrate, bm blue, ccris 4727, tmb plus, tmb, insoluble PubChem CID: 41206 IUPAC Name: 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline SMILES: CC1=CC(=CC(=C1N)C)C2=CC(=C(C(=C2)C)N)C

Alfa Aesar™ Ethyl 2-nitrobenzoate, 97%

CAS: 610-34-4 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.174 MDL Number: MFCD00014696 InChI Key: CPNMAYYYYSWTIV-UHFFFAOYSA-N Synonym: ethyl o-nitrobenzoate, ethyl nitrobenzoate, benzoic acid, o-nitro-, ethyl ester, benzoic acid, 2-nitro-, ethyl ester, nitrobenzoesaureathylester, acmc-1aul6, 2-nitro-benzoic acid ethyl ester PubChem CID: 69123 IUPAC Name: ethyl 2-nitrobenzoate SMILES: CCOC(=O)C1=CC=CC=C1[N+](=O)[O-]

Alfa Aesar™ N,N-Dicyclohexyl-3-methylbenzamide, 97%

CAS: 349090-11-5 Molecular Formula: C20H29NO Molecular Weight (g/mol): 299.458 MDL Number: MFCD00594221 InChI Key: YXPMPPOIMVVDFJ-UHFFFAOYSA-N PubChem CID: 4068782 IUPAC Name: N,N-dicyclohexyl-3-methylbenzamide SMILES: CC1=CC=CC(=C1)C(=O)N(C2CCCCC2)C3CCCCC3

2,4-Dichloro-1-iodobenzene, 97%, Maybridge™

CAS: 29898-32-6 Molecular Formula: C6H3Cl2I Molecular Weight (g/mol): 272.894 InChI Key: ZQKJCBDCOGLKCQ-UHFFFAOYSA-N Synonym: 1,3-dichloro-4-iodobenzene, 2,4-dichloroiodobenzene, benzene, 2,4-dichloro-1-iodo, 1-iodo-2,4-dichlorobenzene, pubchem3692, 2,4-dichlor-jodbenzol, acmc-209hbu, 1,3-dichloro4-iodobenzene, 1,3-dichloro 4-iodobenzene, 2,4-dichloro-1-iodo-benzene PubChem CID: 96864 IUPAC Name: 2,4-dichloro-1-iodobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)I

Alfa Aesar™ 3-(Trifluoromethyl)phenol, 98+%

CAS: 98-17-9 Molecular Formula: C7H5F3O Molecular Weight (g/mol): 162.111 MDL Number: MFCD00002299 InChI Key: UGEJOEBBMPOJMT-UHFFFAOYSA-N Synonym: 3-trifluoromethyl phenol, 3-hydroxybenzotrifluoride, m-trifluoromethylphenol, m-hydroxybenzotrifluoride, phenol, 3-trifluoromethyl, m-trifluoromethyl phenol, alpha,alpha,alpha-trifluoro-m-cresol, a,a,a-trifluoro-m-cresol PubChem CID: 7376 IUPAC Name: 3-(trifluoromethyl)phenol SMILES: C1=CC(=CC(=C1)O)C(F)(F)F

Alfa Aesar™ 2,4,6-Triisopropylbenzeneboronic acid, 98%

CAS: 154549-38-9 Molecular Formula: C15H25BO2 Molecular Weight (g/mol): 248.173 MDL Number: MFCD02683099 InChI Key: FGFYEKLWZBTLEW-UHFFFAOYSA-N Synonym: 2,4,6-triisopropylphenyl boronic acid, 2,4,6-triisopropylphenylboronic acid, 2,4,6-triisopropylbenzeneboronic acid, 2,4,6-tri propan-2-yl phenyl boronic acid, 2,4,6-tris propan-2-yl phenyl boronic acid, acmc-209dav, 2,4,6-triisopropylphenyiboronic acid, 2,4,6-triisopropylphenyl boronicacid PubChem CID: 15153544 IUPAC Name: [2,4,6-tri(propan-2-yl)phenyl]boronic acid SMILES: B(C1=C(C=C(C=C1C(C)C)C(C)C)C(C)C)(O)O

Alfa Aesar™ 3-Chloro-2,4,5,6-tetrafluorobenzoyl chloride, 98%

CAS: 292621-58-0 Molecular Formula: C7Cl2F4O Molecular Weight (g/mol): 246.97 MDL Number: MFCD03001175 InChI Key: GNXAQPALNSLOBK-UHFFFAOYSA-N Synonym: acmc-1cptj, 3-chloro-2,4,5,6-tetrafluorobenzoylchloride, benzoyl chloride,3-chloro-2,4,5,6-tetrafluoro, 3-chloranyl-2,4,5,6-tetrakis fluoranyl benzoyl chloride PubChem CID: 2783249 IUPAC Name: 3-chloro-2,4,5,6-tetrafluorobenzoyl chloride SMILES: C1(=C(C(=C(C(=C1F)Cl)F)F)F)C(=O)Cl

Alfa Aesar™ 4-(Bromomethyl)benzoic acid, 97%

CAS: 6232-88-8 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00002567 InChI Key: CQQSQBRPAJSTFB-UHFFFAOYSA-N Synonym: 4-bromomethyl benzoic acid, alpha-bromo-p-toluic acid, benzoic acid, 4-bromomethyl, p-bromomethyl benzoic acid, 4-carboxybenzyl bromide, 4-bromomethyl-benzoic acid, a-bromo-p-toluic acid, p-carboxybenzyl bromide, p-bromomethylbenzoic acid PubChem CID: 22599 IUPAC Name: 4-(bromomethyl)benzoic acid SMILES: C1=CC(=CC=C1CBr)C(=O)O

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