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

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-]

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

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

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

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

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

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™ 4-Bromobenzoic acid, 98+%

CAS: 586-76-5 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.019 MDL Number: MFCD00002529 InChI Key: TUXYZHVUPGXXQG-UHFFFAOYSA-N Synonym: p-bromobenzoic acid, benzoic acid, 4-bromo, p-carboxybromobenzene, benzoic acid, p-bromo, p-bromobenzenecarboxylic acid, 4-bromo-benzoic acid, 4-brom-benzoesaeure, 4-carboxybromobenzene, para bromo benzoic acid, 4bromo-benzoic acid PubChem CID: 11464 ChEBI: CHEBI:60698 IUPAC Name: 4-bromobenzoic acid SMILES: C1=CC(=CC=C1C(=O)O)Br

4-Cyanobenzoic acid, 99%, ACROS Organics™

CAS: 619-65-8 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.13 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid, benzoic acid, 4-cyano, p-carboxybenzonitrile, 4-carboxybenzonitrile, benzoic acid, p-cyano, 4-cyano-benzoic acid, 4-cyano benzoic acid, benzoicacid, 4-cyano, 4-cyanobenzoicacid, para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O

4-Fluorobenzyl bromide, 97%, ACROS Organics™

CAS: 459-46-1 Molecular Formula: C7H6BrF Molecular Weight (g/mol): 189.03 MDL Number: MFCD00000359 InChI Key: NVNPLEPBDPJYRZ-UHFFFAOYSA-N Synonym: 4-fluorobenzyl bromide, 1-bromomethyl-4-fluorobenzene, p-fluorobenzyl bromide, 4-fluorobenzylbromide, benzene, 1-bromomethyl-4-fluoro, alpha-bromo-p-fluorotoluene, alpha-bromo-4-fluorotoluene, 1-bromomethyl-4-fluoro-benzene, 4-bromomethyl-1-fluorobenzene, para-fluorobenzyl bromide PubChem CID: 68021 IUPAC Name: 1-(bromomethyl)-4-fluorobenzene SMILES: C1=CC(=CC=C1CBr)F

2-Bromo-1-chloro-4-iodobenzene, 98%, ACROS Organics™

CAS: 31928-46-8 Molecular Formula: C6H3BrClI Molecular Weight (g/mol): 317.35 InChI Key: KSCPVCBJIZDZER-UHFFFAOYSA-N Synonym: 1-bromo-2-chloro-5-iodobenzene, 2-bromo-1-chloro-4-iodo-benzene, benzene, 2-bromo-1-chloro-4-iodo, acmc-209hpp, 3-bromo-4-chloroiodobenzene, 3-bromo-4-chloro-1-iodobenzene, benzene,2-bromo-1-chloro-4-iodo, 2-bromanyl-1-chloranyl-4-iodanyl-benzene PubChem CID: 50999503 IUPAC Name: 2-bromo-1-chloro-4-iodobenzene SMILES: C1=CC(=C(C=C1I)Br)Cl

Alfa Aesar™ 1-Bromo-4-(trifluoromethoxy)benzene, 98%

CAS: 407-14-7 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.007 MDL Number: MFCD00040834 InChI Key: SEAOBYFQWJFORM-UHFFFAOYSA-N Synonym: 1-bromo-4-trifluoromethoxy benzene, 4-trifluoromethoxy bromobenzene, 4-bromo trifluoromethoxy benzene, 4-trifluoromethoxybromobenzene, p-bromotrifluoromethoxybenzene, benzene, 1-bromo-4-trifluoromethoxy, 4-bromo-1-trifluoromethoxy benzene, p-trifluoromethoxybromobenzene, 4-bromotrifluoromethoxybenzene, 4-bromo-trifluoromethoxybenzene PubChem CID: 521008 IUPAC Name: 1-bromo-4-(trifluoromethoxy)benzene SMILES: C1=CC(=CC=C1OC(F)(F)F)Br

4,5-Dimethoxy-2-nitrobenzyl bromide, 97%, ACROS Organics™

CAS: 53413-67-5 Molecular Formula: C9H10BrNO4 Molecular Weight (g/mol): 276.09 InChI Key: UEKFEYNZISYRRH-UHFFFAOYSA-N Synonym: 1-bromomethyl-4,5-dimethoxy-2-nitrobenzene, 4,5-dimethoxy-2-nitrobenzyl bromide, 1-bromomethyl-2-nitro-4,5-dimethoxybenzene, bmndmb, benzene, 1-bromomethyl-4,5-dimethoxy-2-nitro, 6-nitroveratryl bromide, acmc-1ao6p, 4,5-dimenoxy-2-nitrobenzyl bromide, 2-nitro-4,5-dimethoxybenzyl bromide, 1-bromomethyl-4,5-dimethoxynitrobenzene PubChem CID: 3016812 IUPAC Name: 1-(bromomethyl)-4,5-dimethoxy-2-nitrobenzene SMILES: COC1=C(C=C(C(=C1)CBr)[N+](=O)[O-])OC

3-Nitrobenzyl chloride, 99%, ACROS Organics™

CAS: 619-23-8 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00007272 InChI Key: APGGSERFJKEWFG-UHFFFAOYSA-N Synonym: 3-nitrobenzyl chloride, 1-chloromethyl-3-nitrobenzene, m-nitrobenzyl chloride, alpha-chloro-3-nitrotoluene, benzene, 1-chloromethyl-3-nitro, toluene, alpha-chloro-m-nitro, .alpha.-chloro-m-nitrotoluene, unii-ojl133898o, 3-nitrobenzylchloride, ccris 2324 PubChem CID: 12078 IUPAC Name: 1-(chloromethyl)-3-nitrobenzene SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CCl

Alfa Aesar™ 3-Fluoro-2-methylaniline, 98+%

CAS: 443-86-7 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.146 MDL Number: MFCD00007760 InChI Key: SLDLVGFPFFLYBM-UHFFFAOYSA-N Synonym: 3-fluoro-o-toluidine, 2-fluoro-6-aminotoluene, 2-amino-6-fluorotoluene, 6-amino-2-fluorotoluene, 3-fluoro-2-methyl-aniline, benzenamine, 3-fluoro-2-methyl, 3-fluoro-2-methylphenylamine, 2-methyl-3-fluoroaniline, hydrochloride, 3-fluor-2-methylanilin PubChem CID: 285553 IUPAC Name: 3-fluoro-2-methylaniline SMILES: CC1=C(C=CC=C1F)N

Alfa Aesar™ 4-Bromo-3-methoxyaniline, 97+%

CAS: 19056-40-7 Molecular Formula: C7H8BrNO Molecular Weight (g/mol): 202.051 MDL Number: MFCD05664063 InChI Key: RUTNWXBHRAIQSP-UHFFFAOYSA-N Synonym: 5-amino-2-bromoanisole, 4-bromo-m-anisidine, 4-bromo-3-methoxy-phenylamine, 4-bromo-3-methoxy-aniline, 3-methoxy-4-bromoaniline, 4-bromo-3-methoxy aniline, 4-bromo-3-methoxyphenylamine, benzenamine, 4-bromo-3-methoxy, 4-bromo-3-methoxybenzenamine, pubchem3794 PubChem CID: 7018254 IUPAC Name: 4-bromo-3-methoxyaniline SMILES: COC1=C(C=CC(=C1)N)Br

Alfa Aesar™ Bis(diphenylphosphinomethyl)phenylphosphine oxide, 95%

CAS: 21851-89-8 Molecular Formula: C32H29O3P3 MDL Number: MFCD00482218 Synonym: bis diphenylphosphinomethyl phenylphosphine oxide, diphenylphosphanyl methyl phenyl phosphoryl methyl diphenylphosphane, 1,1,3,5,5-pentaphenyl-1,3,5-triphosphapentane trioxide

Alfa Aesar™ Diphenyl phosphorochloridate, 97%

CAS: 2524-64-3 Molecular Formula: C12H10ClO3P Molecular Weight (g/mol): 268.633 MDL Number: MFCD00003030 InChI Key: BHIIGRBMZRSDRI-UHFFFAOYSA-N Synonym: diphenyl chlorophosphate, diphenyl phosphorochloridate, diphenylchlorophosphate, phosphorochloridic acid, diphenyl ester, chlorodiphenyl phosphate, o,o-diphenyl chlorophosphate, chlorodiphenoxyphosphine oxide, diphenoxychlorophosphine oxide, diphenyl chlorophosphonate, diphenylphosphoric acid monochloride PubChem CID: 75654 IUPAC Name: [chloro(phenoxy)phosphoryl]oxybenzene SMILES: C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)Cl

Alfa Aesar™ (R)-(+)-1-(2-Bromophenyl)ethanol, 98%

CAS: 76116-20-6 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD00216591 InChI Key: DZLZSFZSPIUINR-ZCFIWIBFSA-N Synonym: r-1-2-bromophenyl ethanol, 1r-1-2-bromophenyl ethanol, 1r-1-2-bromophenyl ethan-1-ol, pubchem5686, r-+-1-2-bromophenyl ethanol, r-+-2-bromo-, a-methylbenzyl alcohol, benzenemethanol,2-bromo-a-methyl-, ar, r-+-2-bromo-alpha-methylbenzyl alcohol, r-+-2-bromo-alpha-methylbenzyl alcoh PubChem CID: 2734868 IUPAC Name: (1R)-1-(2-bromophenyl)ethanol SMILES: CC(C1=CC=CC=C1Br)O

Alfa Aesar™ 3-Fluoro-4-methoxybenzaldehyde, 98%

CAS: 351-54-2 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00003349 InChI Key: SOQCZBSZZLWDGU-UHFFFAOYSA-N Synonym: 3-fluoro-p-anisaldehyde, 3-fluoro-4-methoxy-benzaldehyde, 3-fluoro-4-anisaldehyde, benzaldehyde, 3-fluoro-4-methoxy, 3-fluoro-4-methoxy benzaldehyde, 3-fluoroanisaldehyde, 3-fluoro-anisaldehyde, pubchem1448, acmc-209idn, 2-fluoro-4-formylanisole PubChem CID: 67696 IUPAC Name: 3-fluoro-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)F

4-Bromophenylboronic acid, 98%, ACROS Organics™

CAS: 5467-74-3 Molecular Formula: C6H6BBrO2 Molecular Weight (g/mol): 200.83 MDL Number: MFCD00002104 InChI Key: QBLFZIBJXUQVRF-UHFFFAOYSA-N Synonym: 4-bromophenyl boronic acid, 4-bromobenzeneboronic acid, 4-bromophenylboric acid, p-bromophenylboronic acid, p-bromophenylboric acid, p-bromobenzeneboronic acid, boronic acid, 4-bromophenyl, benzeneboronic acid, p-bromo, p-bromophenyl boronic acid, 4-bromo phenyl boronic acid PubChem CID: 79599 IUPAC Name: (4-bromophenyl)boronic acid SMILES: B(C1=CC=C(C=C1)Br)(O)O

Alfa Aesar™ 3-(Trifluoromethoxy)benzyl bromide, 98%

CAS: 159689-88-0 Molecular Formula: C8H6BrF3O Molecular Weight (g/mol): 255.034 MDL Number: MFCD00061271 InChI Key: QSIVWRRHVXSDNE-UHFFFAOYSA-N Synonym: 3-trifluoromethoxy benzyl bromide, 1-bromomethyl-3-trifluoromethoxy benzene, 3-trifluoromethoxybenzyl bromide, alpha-bromo-3-trifluoromethoxy toluene, 3-trifluoromethoxy benzylbromide, m-trifluoromethoxy benzyl bromide, 3-bromomethyl phenoxy trifluoromethane, 1-bromomethyl-3-trifluoromethoxy-benzene, benzene, 1-bromomethyl-3-trifluoromethoxy PubChem CID: 737176 IUPAC Name: 1-(bromomethyl)-3-(trifluoromethoxy)benzene SMILES: C1=CC(=CC(=C1)OC(F)(F)F)CBr

3-Bromo-2,6-dimethoxybenzoic acid, ≥97%, Maybridge™

CAS: 73219-89-3 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.071 MDL Number: MFCD00052933 InChI Key: CUQANLQRQJHIQE-UHFFFAOYSA-N Synonym: maybridge1_001596, acmc-1bfe7, 2,6-dimethoxy-3-bromobenzoic acid, benzoic acid,3-bromo-2,6-dimethoxy, benzoic acid, 3-bromo-2,6-dimethoxy PubChem CID: 2774744 IUPAC Name: 3-bromo-2,6-dimethoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)Br)OC)C(=O)O

Alfa Aesar™ 3-(Trifluoromethoxy)aniline, 98%

CAS: 1535-73-5 Molecular Formula: C7H6F3NO Molecular Weight (g/mol): 177.126 MDL Number: MFCD00041511 InChI Key: SADHVOSOZBAAGL-UHFFFAOYSA-N Synonym: 3-trifluoromethoxy aniline, 3-trifluoromethoxy-phenylamine, m-aminophenyl trifluoromethyl ether, m-trifluoromethoxy aniline, benzenamine, 3-trifluoromethoxy, alpha,alpha,alpha-trifluoro-m-anisidine, 3-trifluoromethoxy benzenamine, 3-trifluoromethoxy phenylamine, pubchem4507 PubChem CID: 73753 IUPAC Name: 3-(trifluoromethoxy)aniline SMILES: C1=CC(=CC(=C1)OC(F)(F)F)N

Alfa Aesar™ 4-Methoxybenzylamine, 98+%

CAS: 2393-23-9 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00008122 InChI Key: IDPURXSQCKYKIJ-UHFFFAOYSA-N Synonym: 4-methoxybenzylamine, 4-methoxyphenyl methanamine, benzenemethanamine, 4-methoxy, p-methoxybenzylamine, 4-methoxy-benzylamine, anisylamine, benzylamine, p-methoxy, 4-methoxybenzyl amine, 1-4-methoxyphenyl methanamine, 4-methoxyphenyl methylamine PubChem CID: 75452 ChEBI: CHEBI:49837 IUPAC Name: (4-methoxyphenyl)methanamine SMILES: COC1=CC=C(C=C1)CN

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