3,4-Difluoro-ε-oxobenzenehexanoic acid

CAS Registry Number®

898765-77-0
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CAS Name

3,4-Difluoro-ε-oxobenzenehexanoic acid

Molecular Formula

C12H12F2O3

Molecular Mass

242.22

Cite this Page

3,4-Difluoro-ε-oxobenzenehexanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898765-77-0 (retrieved 2024-09-07) (CAS RN: 898765-77-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H12F2O3/c13-9-6-5-8(7-10(9)14)11(15)3-1-2-4-12(16)17/h5-7H,1-4H2,(H,16,17)

InChIKey

InChIKey=HWZQUDHAYOJXEV-UHFFFAOYSA-N

SMILES

C(CCCCC(O)=O)(=O)C1=CC(F)=C(F)C=C1

Canonical SMILES

O=C(O)CCCCC(=O)C1=CC=C(F)C(F)=C1

Other Names for this Substance

  • Benzenehexanoic acid, 3,4-difluoro-ε-oxo-
  • 3,4-Difluoro-ε-oxobenzenehexanoic acid