4-(1-Methylethyl)-γ-oxobenzenebutanoic acid

CAS Registry Number®

6947-81-5

CAS Name

4-(1-Methylethyl)-γ-oxobenzenebutanoic acid

Molecular Formula

C13H16O3

Molecular Mass

220.26

Cite this Page

4-(1-Methylethyl)-γ-oxobenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6947-81-5 (retrieved 2024-11-28) (CAS RN: 6947-81-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    142 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C13H16O3/c1-9(2)10-3-5-11(6-4-10)12(14)7-8-13(15)16/h3-6,9H,7-8H2,1-2H3,(H,15,16)

InChIKey

InChIKey=CRTBQADLERFRSD-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)(=O)C1=CC=C(C(C)C)C=C1

Canonical SMILES

O=C(O)CCC(=O)C1=CC=C(C=C1)C(C)C

Other Names for this Substance

  • Benzenebutanoic acid, 4-(1-methylethyl)-γ-oxo-
  • Propionic acid, 3-(p-isopropylbenzoyl)-
  • 4-(1-Methylethyl)-γ-oxobenzenebutanoic acid
  • 4-(p-Isopropylphenyl)-4-oxobutyric acid
  • β-(p-Cumoyl)propionic acid

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