CAS 115588-20-0

(αS)-α-Methyl-4-(2-methylpropyl)benzeneacetyl chloride

Formula: C₁₃H₁₇ClO

InChI: InChI=1S/C13H17ClO/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3/t10-/m0/s1

InChI key: InChIKey=QXVRLFIKHYCFJS-JTQLQIEISA-N

SMILES: [C@H](C(Cl)=O)(C)C1=CC=C(CC(C)C)C=C1

Synonyms:

• (S)-(+)-Ibuprofen acid chloride
• Benzeneacetyl chloride, α-methyl-4-(2-methylpropyl)-, (S)-
• (αS)-α-Methyl-4-(2-methylpropyl)benzeneacetyl chloride
• Benzeneacetyl chloride, α-methyl-4-(2-methylpropyl)-, (αS)-
• (S)-Ibuprofen acid chloride

(S)-(+)-Ibuprofen Acid Chloride

Controlled Product

CAS: 115588-20-0

Stability Moisture Sensitive
Applications (S)-(+)-Ibuprofen Acid Chloride is an intermediate in the synthesis of (S)-(+)-Ibuprofen Propylene Glycol Ester (I140100), a derivative of (S)-(+)-Ibuprofen (I140010), a nonsteroidal anti-inflammatory drug (NSAID).
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),

Formula: C₁₃H₁₇ClO

Color and Shape: Neat

Molecular weight: 224.73

Ref: TR-I140110