Benzene and substituted derivatives
Methyl 4-vinylbenzoate, 96%
CAS: 1076-96-6 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00017218 InChI Key: NUMHUJZXKZKUBN-UHFFFAOYSA-N Synonym: methyl 4-vinylbenzoate,methyl4-vinylbenzoate,methyl p-vinylbenzoate,methyl-4-vinylbenzoate,benzoic acid, 4-ethenyl-, methyl ester,benzoic acid, p-vinyl-, methyl ester,4-vinyl benzoic acid methyl ester,acmc-1brgo,4-vinyl-benzoic acid methyl ester PubChem CID: 583124 IUPAC Name: methyl 4-ethenylbenzoate SMILES: COC(=O)C1=CC=C(C=C)C=C1
4-Hydroxy-3,5-dimethoxyphenylacetic acid, 97%
CAS: 4385-56-2 Molecular Formula: C10H12O5 Molecular Weight (g/mol): 212.201 MDL Number: MFCD00016834 InChI Key: BQBQKSSTFGCRQL-UHFFFAOYSA-N Synonym: 3,5-dimethoxy-4-hydroxyphenylacetic acid,homosyringic acid,2-4-hydroxy-3,5-dimethoxyphenyl acetic acid,4-hydroxy-3,5-dimethoxyphenyl acetic acid,4-hydroxy-3,5-dimethoxyphenylacetic acid,benzeneacetic acid, 4-hydroxy-3,5-dimethoxy,acmc-1aewn,benzeneacetic acid,4-hydroxy-3,5-dimethoxy,4-hydroxy-3,5-dimethoxy-phenyl-acetic acid,4-hydroxy-3,5-dimethoxyphenyl acetic acid # PubChem CID: 78093 IUPAC Name: 2-(4-hydroxy-3,5-dimethoxyphenyl)acetic acid SMILES: COC1=CC(=CC(=C1O)OC)CC(=O)O
4-Chloro-3-methylbenzoic acid, 98%
CAS: 7697-29-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00045853 InChI Key: MRUKIIWRMSYKML-UHFFFAOYSA-N Synonym: 4-chloro-m-toluic acid,4-chloro-3-methyl-benzoic acid,4-chloro-3-methyl benzoic acid,benzoic acid, 4-chloro-3-methyl,m-toluic acid, 4-chloro,pubchem3666,5-carboxy-2-chlorotoluene,acmc-1bg77,ksc497q5r,4-chloranyl-3-methyl-benzoic acid PubChem CID: 282989 IUPAC Name: 4-chloro-3-methylbenzoic acid SMILES: CC1=CC(=CC=C1Cl)C(O)=O
Diethyl terephthalate, 98%
CAS: 636-09-9 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00039891 InChI Key: ONIHPYYWNBVMID-UHFFFAOYSA-N Synonym: diethyl terephthalate,p-diethyl phthalate,diethylterephthalate,terephthalic acid, diethyl ester,1,4-benzenedicarboxylic acid, diethyl ester,diethyl p-phthalate,terephthalic acid diethyl ester,unii-n97x85l3cd,1,4-diethyl benzene-1,4-dicarboxylate,1,4-benzenedicarboxylic acid, 1,4-diethyl ester PubChem CID: 12483 IUPAC Name: diethyl benzene-1,4-dicarboxylate SMILES: CCOC(=O)C1=CC=C(C=C1)C(=O)OCC
3,4-Dimethoxy-N-methylbenzylamine, 97%, Thermo Scientific™
CAS: 63-64-9 Molecular Formula: C10H15NO2 Molecular Weight (g/mol): 181.24 InChI Key: XQODFBIAQVJQHF-UHFFFAOYSA-N Synonym: 3,4-dimethoxybenzyl methylamine,n-methyl-3,4-dimethoxybenzylamine,1-3,4-dimethoxyphenyl-n-methylmethanamine,3,4-dimethoxyphenyl methyl methyl amine,3,4-dimethoxy-n-methylbenzylamine,3,4-dimethoxy-benzyl-methyl-amine,benzenemethanamine, 3,4-dimethoxy-n-methyl,1-3,4-dimethoxyphenyl-n-methyl-methanamine,3,4-dimethoxyphenyl methyl methylamine,3,4-dimethoxybenzyl-n-methylamine PubChem CID: 592161 IUPAC Name: 1-(3,4-dimethoxyphenyl)-N-methylmethanamine SMILES: CNCC1=CC(=C(C=C1)OC)OC
4-Fluoro-2-(trifluoromethyl)benzonitrile, 98+%
CAS: 194853-86-6 Molecular Formula: C8H3F4N Molecular Weight (g/mol): 189.11 MDL Number: MFCD00061283 InChI Key: LCCPQUYXMFXCAC-UHFFFAOYSA-N Synonym: 4-fluoro-2-trifluoromethyl benzonitrile,2-trifluoromethyl-4-fluorobenzonitrile,4-fluoro-2-trifluoromethyl-benzonitrile,2-cyano-5-fluorobenzotrifluoride,alpha,alpha,alpha,4-tetrafluoro-o-tolunitrile,benzonitrile, 4-fluoro-2-trifluoromethyl,4-fluoro-2-trifluoromethyl benzenecarbonitrile,pubchem4802 PubChem CID: 605085 IUPAC Name: 4-fluoro-2-(trifluoromethyl)benzonitrile SMILES: FC1=CC=C(C#N)C(=C1)C(F)(F)F
Vinyltriphenylphosphonium bromide, 97%
CAS: 5044-52-0 Molecular Formula: C20H18BrP Molecular Weight (g/mol): 369.24 MDL Number: MFCD00011807 InChI Key: VRAYVWUMBAJVGH-UHFFFAOYSA-M Synonym: vinyltriphenylphosphonium bromide,triphenyl vinyl phosphonium bromide,schweizer's reagent,ethenyltriphenylphosphonium bromide,ethenyl triphenyl phosphanium bromide,ethenyltriphenylphosphanium bromide,triphenyl-vinyl-phosphonium; bromide,pubchem16334,acmc-1aw2n,vinyltriphenylphosphine bromide PubChem CID: 2723893 IUPAC Name: ethenyl(triphenyl)phosphanium;bromide SMILES: [Br-].C=C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
1-Benzyloxy-4-bromobenzene, 97%
CAS: 6793-92-6 Molecular Formula: C13H11BrO Molecular Weight (g/mol): 263.134 MDL Number: MFCD00028016 InChI Key: OUQSGILAXUXMGI-UHFFFAOYSA-N Synonym: 4-benzyloxybromobenzene,1-benzyloxy-4-bromobenzene,1-bromo-4-phenylmethoxy benzene,1-bromo-4-benzyloxybenzene,4-benzyloxy bromobenzene,1-benzyloxy-4-bromo-benzene,1-bromo-4-phenylmethyl oxy benzene,4-benzyloxy-bromobenzene,p-benzyloxy bromobenzene PubChem CID: 138835 IUPAC Name: 1-bromo-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)Br
2-Biphenylcarboxylic acid, 98%
CAS: 947-84-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00002463 InChI Key: ILYSAKHOYBPSPC-UHFFFAOYSA-N Synonym: 2-biphenylcarboxylic acid,1,1'-biphenyl-2-carboxylic acid,o-phenylbenzoic acid,biphenyl-2-carboxylic acid,biphenylcarboxylic acid,1,1'-biphenyl carboxylic acid,diphenyl-2-carboxylic acid,phenylbenzoic acid PubChem CID: 70357 IUPAC Name: 2-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=CC=C2C(=O)O
N-Ethylbenzylamine, 95%
CAS: 14321-27-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00009031 InChI Key: HVAAHUDGWQAAOJ-UHFFFAOYSA-N Synonym: n-ethylbenzylamine,benzenemethanamine, n-ethyl,ethylbenzylamine,n-benzylethylamine,benzyl ethyl amine,benzylamine, n-ethyl,benzylethylamine,unii-mm8324ke8v,n-benzyl-n-ethylamine,benzyl-ethyl-amine PubChem CID: 84352 IUPAC Name: N-benzylethanamine SMILES: CCNCC1=CC=CC=C1
p-Toluenesulfonyl fluoride, 98%
CAS: 455-16-3 Molecular Formula: C7H7FO2S Molecular Weight (g/mol): 174.189 MDL Number: MFCD00007421 InChI Key: IZZYABADQVQHLC-UHFFFAOYSA-N Synonym: p-toluenesulfonyl fluoride,tosyl fluoride,4-toluenesulfonyl fluoride,benzenesulfonyl fluoride, 4-methyl,4-tolylsulfonyl fluoride,toluene-4-sulfonyl fluoride,p-methylbenzenesulfonyl fluoride,p-toluenesulphonyl fluoride,toluene-p-sulphonyl fluoride,p-methylphenylsulfonyl fluoride PubChem CID: 9965 IUPAC Name: 4-methylbenzenesulfonyl fluoride SMILES: CC1=CC=C(C=C1)S(=O)(=O)F
3-(4-Bromophenyl)-5-methyl-1,2,4-oxadiazole, 97%, Thermo Scientific™
CAS: 118183-92-9 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 MDL Number: MFCD00487341 InChI Key: YWBIOYGLRGIJRT-UHFFFAOYSA-N PubChem CID: 823560 IUPAC Name: 3-(4-bromophenyl)-5-methyl-1,2,4-oxadiazole SMILES: CC1=NC(=NO1)C2=CC=C(C=C2)Br
2-Fluorophenyl isocyanate, 98%
CAS: 16744-98-2 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.113 MDL Number: MFCD00001996 InChI Key: VZNCSZQPNIEEMN-UHFFFAOYSA-N Synonym: 2-fluorophenyl isocyanate,o-fluorophenyl isocyanate,2-fluorophenylisocyanate,benzene, 1-fluoro-2-isocyanato,isocyanic acid 2-fluorophenyl ester,2-fluorobenzenisocyanate,paragos 331045,labotest-bb ltbb005297,pubchem4455,2-flurophenylisocyanate PubChem CID: 85588 IUPAC Name: 1-fluoro-2-isocyanatobenzene SMILES: C1=CC=C(C(=C1)N=C=O)F
2,3,4,5,6-Pentafluorotoluene, 99%
CAS: 771-56-2 Molecular Formula: C7H3F5 Molecular Weight (g/mol): 182.093 MDL Number: MFCD00000298 InChI Key: SXPRVMIZFRCAGC-UHFFFAOYSA-N Synonym: 2,3,4,5,6-pentafluorotoluene,pentafluorotoluene,methyl pentafluorobenzene,pentafluoromethylbenzene,benzene, pentafluoromethyl,methylpentafluorobenzene,benzene, 1,2,3,4,5-pentafluoro-6-methyl,toluene, 2,3,4,5,6-pentafluoro,2,3,4,5,6-pentafluoro-toluene,n-methylpentafluorobenzene PubChem CID: 69869 IUPAC Name: 1,2,3,4,5-pentafluoro-6-methylbenzene SMILES: CC1=C(C(=C(C(=C1F)F)F)F)F
3-Bromophenetole, 98%
CAS: 2655-84-7 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00274287 InChI Key: LQBMPJSTUHWGDE-UHFFFAOYSA-N Synonym: 3-bromophenetole,benzene, 1-bromo-3-ethoxy,m-bromophenetole,3-bromophenyl ethyl ether,1-bromo-3-ethoxy-benzene,3-bromoethoxybenzene,3-bromphenyl ethyl ether,phenetole, m-bromo,m-bromphenetol,3-ethoxybromobenzene PubChem CID: 75867 IUPAC Name: 1-bromo-3-ethoxybenzene SMILES: CCOC1=CC=CC(Br)=C1