4-Chloro-α-(4-methylphenyl)-γ-oxobenzenebutanoic acid

CAS Registry Number®

70596-90-6

CAS Name

4-Chloro-α-(4-methylphenyl)-γ-oxobenzenebutanoic acid

Molecular Formula

C17H15ClO3

Molecular Mass

302.75

Cite this Page

4-Chloro-α-(4-methylphenyl)-γ-oxobenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=70596-90-6 (retrieved 2024-11-24) (CAS RN: 70596-90-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H15ClO3/c1-11-2-4-12(5-3-11)15(17(20)21)10-16(19)13-6-8-14(18)9-7-13/h2-9,15H,10H2,1H3,(H,20,21)

InChIKey

InChIKey=KWNBDPJHEKVDAW-UHFFFAOYSA-N

SMILES

C(CC(=O)C1=CC=C(Cl)C=C1)(C(O)=O)C2=CC=C(C)C=C2

Canonical SMILES

O=C(O)C(C1=CC=C(C=C1)C)CC(=O)C2=CC=C(Cl)C=C2

Other Names for this Substance

  • Benzenebutanoic acid, 4-chloro-α-(4-methylphenyl)-γ-oxo-
  • Hydratropic acid, β-p-chlorobenzoyl-p-methyl-
  • 4-Chloro-α-(4-methylphenyl)-γ-oxobenzenebutanoic acid

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