3-Benzoylpropionic acid

CAS Registry Number®

2051-95-8

CAS Name

3-Benzoylpropionic acid

Molecular Formula

C10H10O3

Molecular Mass

178.18

Cite this Page

3-Benzoylpropionic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2051-95-8 (retrieved 2024-11-21) (CAS RN: 2051-95-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    117-119 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)

InChIKey

InChIKey=KMQLIDDEQAJAGJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCC(=O)C=1C=CC=CC1

Other Names for this Substance

  • Benzenebutanoic acid, γ-oxo-
  • Propionic acid, 3-benzoyl-
  • γ-Oxobenzenebutanoic acid
  • β-Benzoylpropionic acid
  • Propanoic acid, 3-benzoyl-

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration