Benzenoids

Thermo Scientific Chemicals Calconcarboxylic acid, indicator grade

CAS: 3737-95-9 Molecular Formula: C₂₁H₁₄N₂O₇S Molecular Weight (g/mol): 438.4 MDL Number: MFCD00004078 InChI Key: ULIVOAKVRBXKKS-PYCFMQQDSA-N Synonym: calconcarboxylic acid,patton-reeder indicator,calconcarbonic acid,calcon 3-carboxylic acid,patton and reeder's indicator,2-hydroxy-1-2-hydroxy-4-sulfo-1-napthylazo-3-naphthoic acid,2,2'-dihydroxy-4'-sulpho-1,1'-azonaphthalene-3-carboxylic acid,2-naphthalenecarboxylic acid, 3-hydroxy-4-2-hydroxy-4-sulfo-1-naphthalenyl azo,nn PubChem CID: 5895210 IUPAC Name: 3-hydroxy-4-[(2Z)-2-(2-oxo-4-sulfonaphthalen-1-ylidene)hydrazinyl]naphthalene-2-carboxylic acid SMILES: C1=CC=C2C(=C1)C=C(C(=C2NN=C3C4=CC=CC=C4C(=CC3=O)S(=O)(=O)O)O)C(=O)O

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1-Iodo-2-nitrobenzene, 97%, Thermo Scientific Chemicals

CAS: 609-73-4 Molecular Formula: C6H4INO2 Molecular Weight (g/mol): 249.01 MDL Number: MFCD00007088 InChI Key: JXMZUNPWVXQADG-UHFFFAOYSA-N Synonym: 2-iodonitrobenzene,o-iodonitrobenzene,o-nitroiodobenzene,benzene, 1-iodo-2-nitro,2-nitroiodobenzene,2-iodo-1-nitrobenzene,1-iodo-2-nitro-benzene,2-iodo-nitrobenzene,2-nitro-iodobenzene,benzene, iodonitro PubChem CID: 69115 IUPAC Name: 1-iodo-2-nitrobenzene SMILES: [O-][N+](=O)C1=CC=CC=C1I

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2,4,6-Tribromophenol, 98%

CAS: 118-79-6 Molecular Formula: C6H3Br3O Molecular Weight (g/mol): 330.80 MDL Number: MFCD00002150 InChI Key: BSWWXRFVMJHFBN-UHFFFAOYSA-N Synonym: tribromophenol,bromol,bromkal pur 3,xeroform,phenol, 2,4,6-tribromo,flammex 3bp,unii-ys6k3eu393,ccris 1658,great lakes ph-73,5175-83-7 bismuth 3+ salt PubChem CID: 1483 ChEBI: CHEBI:47696 IUPAC Name: 2,4,6-tribromophenol SMILES: OC1=C(Br)C=C(Br)C=C1Br

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Homovanillic acid, 98%

CAS: 306-08-1 Molecular Formula: C₉H₁₀O₄ Molecular Weight (g/mol): 182.18 MDL Number: MFCD00004350 InChI Key: QRMZSPFSDQBLIX-UHFFFAOYSA-N Synonym: homovanillic acid,4-hydroxy-3-methoxyphenylacetic acid,2-4-hydroxy-3-methoxyphenyl acetic acid,vanillacetic acid,benzeneacetic acid, 4-hydroxy-3-methoxy,3-methoxy-4-hydroxyphenylacetic acid,homovaniuic acid,4-hydroxy-3-methoxyphenyl acetic acid,homovanillate,4-hydroxy-3-methoxybenzeneacetic acid PubChem CID: 1738 ChEBI: CHEBI:545959 IUPAC Name: 2-(4-hydroxy-3-methoxyphenyl)acetic acid SMILES: COC1=C(C=CC(=C1)CC(=O)O)O

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alpha-Bromo-o-tolunitrile, 98%

CAS: 22115-41-9 Molecular Formula: C8H6BrN Molecular Weight (g/mol): 196.05 MDL Number: MFCD00001794 InChI Key: QGXNHCXKWFNKCG-UHFFFAOYSA-N Synonym: 2-bromomethyl benzonitrile,2-cyanobenzyl bromide,alpha-bromo-o-tolunitrile,o-cyanobenzyl bromide,a-bromo-o-tolunitrile,alpha bromo-o-tolunitrile,2 bromomethyl benzonitrile,2-bromomethyl-benzonitrile,2-cyanophenyl methyl bromide,benzonitrile, 2-bromomethyl PubChem CID: 89599 IUPAC Name: 2-(bromomethyl)benzonitrile SMILES: BrCC1=CC=CC=C1C#N

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Benzyltriethylammonium bromide, 99%

CAS: 5197-95-5 Molecular Formula: C13H22BrN Molecular Weight (g/mol): 272.23 MDL Number: MFCD00011822 InChI Key: CHQVQXZFZHACQQ-UHFFFAOYSA-M Synonym: benzyltriethylammonium bromide,n-benzyl-n,n-diethylethanaminium bromide,benzyl triethyl ammonium bromide,triethylbenzylammonium bromide,bteab,benzenemethanaminium, n,n,n-triethyl-, bromide,benzyltriethyl ammonium bromide,n-benzyl-n,n,n-triethylammoniumbromide,benzyltriethylazanium bromide,pubchem7797 PubChem CID: 165294 IUPAC Name: benzyl(triethyl)azanium;bromide SMILES: [Br-].CC[N+](CC)(CC)CC1=CC=CC=C1

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4-Hydroxymethylbenzoic acid, 98%

CAS: 3006-96-0 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00017598 InChI Key: WWYFPDXEIFBNKE-UHFFFAOYSA-N Synonym: 4-hydroxymethyl benzoic acid,4-hydroxythylbenzoic acid,unii-9z28l8sthd,hmba linker,4-hydroxymethyl-benzoic acid,benzoic acid, 4-hydroxymethyl,p-hydroxymethyl benzoic acid,4-hydroxymethyl benzoicacid,9z28l8sthd PubChem CID: 76360 IUPAC Name: 4-(hydroxymethyl)benzoic acid SMILES: OCC1=CC=C(C=C1)C(O)=O

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2-Iodophenylacetic acid, 97+%

CAS: 18698-96-9 Molecular Formula: C₈H₇IO₂ Molecular Weight (g/mol): 262.04 MDL Number: MFCD00046546 InChI Key: IUHXGZHKSYYDIL-UHFFFAOYSA-N Synonym: 2-iodophenylacetic acid,2-2-iodophenyl acetic acid,benzeneacetic acid, 2-iodo,2-iodophenyl acetic acid,o-iodophenylacetic acid,2-iodobenzeneacetic acid,2-iodophenylaceticacid,pubchem2552,acmc-209eox,maybridge1_005605 PubChem CID: 2780090 IUPAC Name: 2-(2-iodophenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)I

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3-Bromobenzoyl chloride, 97%

CAS: 1711-09-7 Molecular Formula: C₇H₄BrClO Molecular Weight (g/mol): 219.46 MDL Number: MFCD00000669 InChI Key: PBOOZQFGWNZNQE-UHFFFAOYSA-N Synonym: m-bromobenzoyl chloride,benzoyl chloride, 3-bromo,3-bromobenzoylchloride,benzoyl chloride, m-bromo,3-bromobenzoic acid chloride,attercop-chm at106527,3-brom-benzoylchlorid,3-bromo-benzoylchlorid,3-bromobenzoic chloride,pubchem13574 PubChem CID: 74377 IUPAC Name: 3-bromobenzoyl chloride SMILES: C1=CC(=CC(=C1)Br)C(=O)Cl

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4-(Trifluoromethyl)benzylamine, 97%

CAS: 3300-51-4 Molecular Formula: C8H8F3N Molecular Weight (g/mol): 175.15 MDL Number: MFCD00010220 InChI Key: PRDBLLIPPDOICK-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzylamine,4-trifluoromethylbenzylamine,4-trifluoromethyl phenyl methanamine,1-4-trifluoromethyl phenyl methanamine,4-trifluoromethyl benzyl amine,p-trifluoromethylbenzyl amine,4-trifluoromethyl-benzylamine,p-trifluoromethyl benzylamine,benzenemethanamine, 4-trifluoromethyl PubChem CID: 76804 IUPAC Name: [4-(trifluoromethyl)phenyl]methanamine SMILES: NCC1=CC=C(C=C1)C(F)(F)F

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(S)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee

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meso-1,2-Bis(4-bromophenyl)ethanediamine, 98+%, Thermo Scientific™

CAS: 117903-53-4 Molecular Formula: C₁₄H₁₄Br₂N₂ Molecular Weight (g/mol): 370.09 MDL Number: MFCD00989104 InChI Key: GANMXFWDVICUEK-UHFFFAOYSA-N Synonym: 1,2-bis 4-bromophenyl ethane-1,1-diamine,meso-1,2-bis 4-bromophenyl ethanediamine PubChem CID: 91872995 IUPAC Name: 1,2-bis(4-bromophenyl)ethane-1,1-diamine SMILES: C1=CC(=CC=C1CC(C2=CC=C(C=C2)Br)(N)N)Br

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3,5-Di-tert-butylsalicylic acid, 99%

CAS: 19715-19-6 Molecular Formula: C₁₅H₂₂O₃ Molecular Weight (g/mol): 250.34 MDL Number: MFCD00059058 InChI Key: ZWQBZEFLFSFEOS-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-2-hydroxybenzoic acid,3,5-bis-tert-butylsalicylic acid,3,5-di-tert-butylsalicylic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl hydroxy,benzoic acid, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-ditertbutyl salicylic acid,dibutylsalicylicacid,acmc-1c7qv,3,2-bis 1,1-dimethylethyl-2-hydroxybenzoic acid,ksc466o9n PubChem CID: 88208 IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzoic acid SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C

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3-(Trifluoromethyl)phenethylamine, 98%

CAS: 52516-30-0 Molecular Formula: C₉H₁₀F₃N Molecular Weight (g/mol): 189.18 MDL Number: MFCD00040756 InChI Key: BPVYCXMGJPKOTQ-UHFFFAOYSA-N Synonym: 2-3-trifluoromethyl phenyl ethanamine,3-trifluoromethyl phenethylamine,2-3-trifluoromethylphenyl ethylamine,2-3-trifluoromethyl phenyl ethylamine,phenethylamine, m-trifluoromethyl,m-trifluoromethylphenethylamine,m-trifluoromethyl phenethylamine,benzeneethanamine, 3-trifluoromethyl,2-3-trifluoromethylphenyl-ethylamine PubChem CID: 104223 IUPAC Name: 2-[3-(trifluoromethyl)phenyl]ethanamine SMILES: C1=CC(=CC(=C1)C(F)(F)F)CCN

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1-Phenyl-1,2-propanedione-2-oxime, 99%

CAS: 119-51-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00002115 InChI Key: YPINLRNGSGGJJT-JXMROGBWSA-N Synonym: 1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone PubChem CID: 9566063 IUPAC Name: (2E)-2-hydroxyimino-1-phenylpropan-1-one SMILES: C\C(=N/O)C(=O)C1=CC=CC=C1

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