Benzenoids

Alfa Aesar™ 2,5-Dichlorobenzyl alcohol, 99%

CAS: 34145-05-6 Molecular Formula: C7H6Cl2O Molecular Weight (g/mol): 177.024 MDL Number: MFCD00004607 InChI Key: LCEIGNVIDJNUGF-UHFFFAOYSA-N Synonym: 2,5-dichlorophenyl methanol, 2,5-dichlorobenzyl alcohol, benzenemethanol, 2,5-dichloro, 2,5-dichlorobenzylic alcohol, 2,5-dichloro-phenyl-methanol, 2,5-dichlorobenzylalcohol, acmc-1ad0a, 2,5-dichloro benzylalcohol, 2,5-dichloro-benzyl alcohol, benzenemethanol,2,5-dichloro PubChem CID: 118604 IUPAC Name: (2,5-dichlorophenyl)methanol SMILES: C1=CC(=C(C=C1Cl)CO)Cl

m-Cresol, 99%, ACROS Organics™

CAS: 108-39-4 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002302 InChI Key: RLSSMJSEOOYNOY-UHFFFAOYSA-N Synonym: m-cresol, metacresol, meta-cresol, phenol, 3-methyl, 3-hydroxytoluene, m-methylphenol, 3-cresol, m-kresol, m-oxytoluene, m-toluol PubChem CID: 342 ChEBI: CHEBI:17231 IUPAC Name: 3-methylphenol SMILES: CC1=CC(=CC=C1)O

2-Phenoxyethanol, 99%, ACROS Organics™

CAS: 122-99-6 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol, ethylene glycol monophenyl ether, phenyl cellosolve, ethanol, 2-phenoxy, phenoxytol, phenoxethol, phenoxetol, ethylene glycol phenyl ether, phenoxyethyl alcohol, 1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

Benzopinacole, 98%, ACROS Organics™

CAS: 464-72-2 Molecular Formula: C26H22O2 Molecular Weight (g/mol): 366.45 MDL Number: MFCD00004448 InChI Key: MFEWNFVBWPABCX-UHFFFAOYSA-N Synonym: benzopinacol, benzopinacole, benzopinacone, benzpinacol, benzpinacone, tetraphenylethylene glycol, tetraphenyl-1,2-ethanediol, benzophenone pinacol, 1,1,2,2-tetraphenyl-1,2-ethanediol, 1,2-ethanediol, 1,1,2,2-tetraphenyl PubChem CID: 94766 IUPAC Name: 1,1,2,2-tetraphenylethane-1,2-diol SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O

Tetrakis(triphenylphosphine)palladium(0), 99%, ACROS Organics™

CAS: 14221-01-3 Molecular Formula: C72H60P4Pd Molecular Weight (g/mol): 1155.58 InChI Key: NFHFRUOZVGFOOS-UHFFFAOYSA-N Synonym: tetrakis triphenylphosphine palladium, tetrakis triphenylphosphine palladium 0, pd pph3 4, tetrakis triphenylphosphine palladium o, tetra triphenylphosphine palladium, palladium-tetrakis triphenylphosphine, palladium 0 tetrakis triphenylphosphine, palladium, tetrakis triphenylphosphine-, t-4 PubChem CID: 11979704 IUPAC Name: palladium;triphenylphosphane SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3.[Pd]

Triton™ X-100 (Electrophoresis), Fisher BioReagents™

CAS: 9002-93-1 Molecular Formula: C16H26O2 Molecular Weight (g/mol): 250.382 InChI Key: JYCQQPHGFMYQCF-UHFFFAOYSA-N Synonym: Polyethylene Glycol p-tert-Octylphenyl Ether PubChem CID: 5590 IUPAC Name: 2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethanol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OCCO

Clofazimine, 98%, ACROS Organics™

CAS: 2030-63-9 Molecular Formula: C27H22Cl2N4 Molecular Weight (g/mol): 473.4 InChI Key: WDQPAMHFFCXSNU-UHFFFAOYSA-N PubChem CID: 2794 ChEBI: CHEBI:3749

p-Toluidine, 99%, crystalline molten mass, ACROS Organics™

CAS: 106-49-0 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 InChI Key: RZXMPPFPUUCRFN-UHFFFAOYSA-N Synonym: p-toluidine, 4-toluidine, p-tolylamine, 4-aminotoluene, benzenamine, 4-methyl, 4-methylbenzenamine, p-methylaniline, p-methylbenzenamine, p-toluidin, p-aminotoluene PubChem CID: 7813 ChEBI: CHEBI:37825 IUPAC Name: 4-methylaniline SMILES: CC1=CC=C(C=C1)N

Resorcinol, 98%, ACROS Organics™

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol, 1,3-benzenediol, resorcin, 1,3-dihydroxybenzene, 3-hydroxyphenol, m-hydroquinone, resorcine, m-dihydroxybenzene, m-hydroxyphenol, m-benzenediol PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O

Crystal Violet, certified, 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-]

alpha-Chloro-o-xylene, 99%, ACROS Organics™

CAS: 552-45-4 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000899 InChI Key: VQRBXYBBGHOGFT-UHFFFAOYSA-N Synonym: 2-methylbenzyl chloride, 1-chloromethyl-2-methylbenzene, o-xylyl chloride, alpha-chloro-o-xylene, o-methylbenzyl chloride, o-chloromethyl toluene, benzene, 1-chloromethyl-2-methyl, 2-methylbenzylchloride, 2-chloromethyl toluene, unii-eqt3v044tw PubChem CID: 11093 IUPAC Name: 1-(chloromethyl)-2-methylbenzene SMILES: CC1=CC=CC=C1CCl

Fullerene C60, 99.9%, ACROS Organics™

CAS: 99685-96-8 Molecular Formula: C60 Molecular Weight (g/mol): 720.65 MDL Number: MFCD00151408 InChI Key: XMWRBQBLMFGWIX-UHFFFAOYSA-N Synonym: fullerene, buckminsterfullerene, buckyball, fullerene 60, 60 fullerene, footballene, fullerene-c60, 5,6 fullerene-c60-ih PubChem CID: 123591 ChEBI: CHEBI:33128 IUPAC Name: (C\{60}-I\{h})[5,6]fullerene SMILES: C12=C3C4=C5C6=C1C7=C8C9=C1C%10=C%11C(=C29)C3=C2C3=C4C4=C5C5=C9C6=C7C6=C7C8=C1C1=C8C%10=C%10C%11=C2C2=C3C3=C4C4=C5C5=C%11C%12=C(C6=C95)C7=C1C1=C%12C5=C%11C4=C3C3=C5C(=C81)C%10=C23

m-Xylene, 99%, Extra Dry, AcroSeal™, ACROS Organics™

CAS: 108-38-3 Molecular Formula: C8H10 Molecular Weight (g/mol): 106.168 MDL Number: MFCD00008536 InChI Key: IVSZLXZYQVIEFR-UHFFFAOYSA-N Synonym: m-xylene, 1,3-dimethylbenzene, m-xylol, m-dimethylbenzene, meta-xylene, m-methyltoluene, 3-xylene, benzene, 1,3-dimethyl, 1,3-dimethylbenzol, santosol 150 PubChem CID: 7929 ChEBI: CHEBI:28488 IUPAC Name: 1,3-xylene SMILES: CC1=CC(=CC=C1)C

Alfa Aesar™ 1-Bromo-2-cyclohexylbenzene, 97%

CAS: 59734-92-8 Molecular Formula: C12H15Br Molecular Weight (g/mol): 239.156 MDL Number: MFCD02093987 InChI Key: BXMDAGGQRIDSPA-UHFFFAOYSA-N Synonym: 1-bromo-2-cyclohexyl-benzene, benzene, 1-bromo-2-cyclohexyl, acmc-20aoxa, l-bromo-2-cyclohexylbenzene, 2-bromo-1-cyclohexylbenzene PubChem CID: 10944502 IUPAC Name: 1-bromo-2-cyclohexylbenzene SMILES: C1CCC(CC1)C2=CC=CC=C2Br

Alfa Aesar™ 4-Methylbenzoic anhydride, 97%

CAS: 13222-85-0 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048100 InChI Key: BJMLLSSSTGHJJE-UHFFFAOYSA-N Synonym: 4-methylbenzoic anhydride, 4-methylphenyl anhydride, 4-methylbenzoic acid anhydride, p-toluic anhydride, 4-methylbenzene-1-carboxylic anhydride, 4-methylbenzoyl 4-methylbenzoate, bis 4-methylbenzoic anhydride, p-toluylsaureanhydrid, para-toluic anhydride, 4-methylbenzoicanhydride PubChem CID: 139413 IUPAC Name: (4-methylbenzoyl) 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)C

2-Hydroxy-5-(trifluoromethoxy)benzaldehyde, 99%, ACROS Organics™

CAS: 93249-62-8 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00075249 InChI Key: WQUZBERVMUEJTD-UHFFFAOYSA-N Synonym: 2-hydroxy-5-trifluoromethoxy benzaldehyde, 5-trifluoromethoxy salicylaldehyde, benzaldehyde, 2-hydroxy-5-trifluoromethoxy, acmc-20antc, 5-trifluoromethoxysalicylaldehyde, 5-trifluoromethoxy-salicylaldehyde, 2-hydroxy-5-trifluoromethoxy-benzaldehyde, 20hydroxy-5-trifluoromethoxy benzaldehyde, 2-oxidanyl-5-trifluoromethyloxy benzaldehyde, benzaldehyde,2-hydroxy-5-trifluoromethoxy PubChem CID: 1268058 IUPAC Name: 2-hydroxy-5-(trifluoromethoxy)benzaldehyde SMILES: C1=CC(=C(C=C1OC(F)(F)F)C=O)O

2-Cyano-6-hydroxybenzothiazole, 97%, ACROS Organics™

CAS: 939-69-5 Molecular Formula: C8H4N2OS Molecular Weight (g/mol): 176.2 InChI Key: SQAVNBZDECKYOT-UHFFFAOYSA-N Synonym: 2-cyano-6-hydroxybenzothiazole, 6-hydroxybenzo d thiazole-2-carbonitrile, 6-hydroxybenzothiazole-2-carbonitrile, 2-benzothiazolecarbonitrile, 6-hydroxy, 6-hydroxy-2-benzothiazolecarbonitrile, pubchem19680, 6-hydroxy-2-cyanobenzothiazole, 6-hydroxy-2-cyano-benzothiazole, 6-hydroxy-benzothiazole-2-carbonitrile, 6-hydroxy-benzo d thiazole-2-carbonitrile PubChem CID: 9881912 IUPAC Name: 6-hydroxy-1,3-benzothiazole-2-carbonitrile SMILES: C1=CC2=C(C=C1O)SC(=N2)C#N

Benzoic acid, 99%, Alfa Aesar™

CAS: 65-85-0 Molecular Formula: C7H6O2 Molecular Weight (g/mol): 122.123 MDL Number: MFCD00002398 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid, dracylic acid, benzeneformic acid, carboxybenzene, phenylformic acid, benzenemethanoic acid, phenylcarboxylic acid, retardex, benzoesaeure gk, benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O

Benzyl Alcohol, 99%, Pure, ACROS Organics™

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol, benzenemethanol, phenylcarbinol, benzoyl alcohol, hydroxytoluene, benzenecarbinol, phenylmethyl alcohol, alpha-toluenol, hydroxymethyl benzene, benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: C1=CC=C(C=C1)CO

1,2-Phthalic dicarboxaldehyde, 98+%, ACROS Organics™

CAS: 643-79-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00003335 InChI Key: ZWLUXSQADUDCSB-UHFFFAOYSA-N Synonym: o-phthalaldehyde, o-phthaldialdehyde, benzene-1,2-dicarboxaldehyde, 1,2-benzenedicarboxaldehyde, phthaldialdehyde, phthalic aldehyde, phthalic dialdehyde, phthalyldicarboxaldehyde, ortho-phthalaldehyde, o-phthaldehyde PubChem CID: 4807 ChEBI: CHEBI:70851 IUPAC Name: phthalaldehyde SMILES: C1=CC=C(C(=C1)C=O)C=O

Sodium hippurate, 96%, Alfa Aesar™

CAS: 532-94-5 Molecular Formula: C9H8NNaO3 Molecular Weight (g/mol): 201.157 MDL Number: MFCD00002693 InChI Key: ZBCAZEFVTIBZJS-UHFFFAOYSA-M Synonym: sodium hippurate, hippuric acid sodium salt, sodium 2-benzamidoacetate, n-benzoylglycine sodium salt, glycine, n-benzoyl-, monosodium salt, ccris 5812, hippuric acid, monosodium salt, glycine, n-benzoyl-, sodium salt 1:1, hippurate sodium, benzoylaminoacetic acid sodium salt PubChem CID: 516953 IUPAC Name: sodium;2-benzamidoacetate SMILES: C1=CC=C(C=C1)C(=O)NCC(=O)[O-].[Na+]

Alfa Aesar™ p-Toluenesulfonic acid sodium salt, 90+%

CAS: 657-84-1 Molecular Formula: C7H7NaO3S Molecular Weight (g/mol): 194.18 MDL Number: MFCD00798566 InChI Key: KVCGISUBCHHTDD-UHFFFAOYSA-M Synonym: sodium p-toluenesulfonate, sodium 4-methylbenzenesulfonate, sodium tosylate, p-toluenesulfonic acid sodium salt, sodium toluenesulfonate, sodium toluenesulphonate, tosylate, sodium, naxonate hydrotrope, cyclophil sts 70, eltesol st 34 PubChem CID: 3720192 IUPAC Name: sodium;4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Triphenylmethanol, 98%, Alfa Aesar™

CAS: 76-84-6 Molecular Formula: C19H16O Molecular Weight (g/mol): 260.336 MDL Number: MFCD00004445 InChI Key: LZTRCELOJRDYMQ-UHFFFAOYSA-N Synonym: triphenylcarbinol, trityl alcohol, tritanol, triphenylmethyl alcohol, triphenyl methanol, triphenyl carbinol, methanol, triphenyl, unii-u97q0ou9kb, triphenyl-methanol, benzenemethanol, .alpha.,.alpha.-diphenyl PubChem CID: 6457 IUPAC Name: triphenylmethanol SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

1,2,4-Trichlorobenzene, 99%, pure, ACROS Organics™

CAS: 120-82-1 Molecular Formula: C6H3Cl3 Molecular Weight (g/mol): 181.45 MDL Number: MFCD00000547 InChI Key: PBKONEOXTCPAFI-UHFFFAOYSA-N Synonym: benzene, 1,2,4-trichloro, unsym-trichlorobenzene, hostetex l-pec, trojchlorobenzen, 1,2,4-trichlorbenzol, 1,2,4-trichlorobenzol, 1,3,4-trichlorobenzene, trichlorobenzene a, 1,2,5-trichlorobenzene, as-trichlorobenzene PubChem CID: 13 ChEBI: CHEBI:28222 IUPAC Name: 1,2,4-trichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)Cl

1,3-Dioxolane, 99.5+%, pure, stabilized, ACROS Organics™

CAS: 646-06-0 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00003207 InChI Key: WNXJIVFYUVYPPR-UHFFFAOYSA-N Synonym: dioxolane, glycolformal, formal glycol, 1,3-dioxolan, 1,3-dioxacyclopentane, 1,3-dioxalane, ethylene glycol formal, glycol methylene ether, glycol formal, dioxolan czech PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

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