2-(4-Isobutylphenyl)propanal

CAS: 51407-46-6

Ref. TR-I780360

Informação sobre produto

• Nome: 2-(4-Isobutylphenyl)propanal
• Sinónimos: (2RS)-2-[4-(2-Methylpropyl)phenyl]propan-1-al, (2RS)-2-[4-(2-Methylpropyl)phenyl]propan-1-al, Benzeneacetaldehyde, a-methyl-4-(2-methylpropyl)-, 2-(p-Isobutylphenyl)propanal, 2-(p-Isobutylphenyl)propionaldehyde, 2-[4-(2-Methylpropyl)Phenyl]Propanal, Benzeneacetaldehyde, α-methyl-4-(2-methylpropyl)-, Ibuprofenal, p-Isobutyl-2-phenylpropionaldehyde, α-(p-Isobutylphenyl)propionaldehyde, α-Methyl-4-(2-methylpropyl)benzeneacetaldehyde, 2-(4-Isobutylphenyl)propionaldehyde

Descrição

Stability Hygroscopic
Applications 2-(4-Isobutylphenyl)propanal is an impurity of the drug Ibuprofen (I140000), a selective cyclooxygenase inhibitor that also inhibits PGH synthase-1 and PGH synthase-2 with comparable potency.
References Busson, M., et al.: J. Int. Med Res., 14, 53 (1986), Meade, E.A., et al.: J. Biol. Chem., 268, 6610 (1993), Davies, N.M., et al.: Clin. Pharmacokinet., 34, 101 (1998); (4) Chem. and Eng. News p9, July 4 (2016)

• Marca: TRC

Propriedades químicas

• Peso molecular: 190.28
• Fórmula: C₁₃H₁₈O
• Cor/forma: Neat
• InChI: InChI=1S/C13H18O/c1-10(2)8-12-4-6-13(7-5-12)11(3)9-14/h4-7,9-11H,8H2,1-3H3
• Chave InChI: InChIKey=DMZVZANOMJGHKO-UHFFFAOYSA-N
• SMILES: CC(C)Cc1ccc(C(C)C=O)cc1