β,2-Dimethyl-δ-oxobenzenepentanoic acid

CAS Registry Number®

951892-74-3
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CAS Name

β,2-Dimethyl-δ-oxobenzenepentanoic acid

Molecular Formula

C13H16O3

Molecular Mass

220.26

Cite this Page

β,2-Dimethyl-δ-oxobenzenepentanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951892-74-3 (retrieved 2024-08-26) (CAS RN: 951892-74-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

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

InChIKey

InChIKey=CWCXAHALCGEMCW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CC(C)CC(=O)C=1C=CC=CC1C

Other Names for this Substance

  • Benzenepentanoic acid, β,2-dimethyl-δ-oxo-
  • β,2-Dimethyl-δ-oxobenzenepentanoic acid