4-Chloro-3-fluoro-β-oxobenzenepropanenitrile

CAS Registry Number®

267880-80-8
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CAS Name

4-Chloro-3-fluoro-β-oxobenzenepropanenitrile

Molecular Formula

C9H5ClFNO

Molecular Mass

197.59

Cite this Page

4-Chloro-3-fluoro-β-oxobenzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=267880-80-8 (retrieved 2024-08-09) (CAS RN: 267880-80-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H5ClFNO/c10-7-2-1-6(5-8(7)11)9(13)3-4-12/h1-2,5H,3H2

InChIKey

InChIKey=XGQSPQDQOKUKRN-UHFFFAOYSA-N

SMILES

C(CC#N)(=O)C1=CC(F)=C(Cl)C=C1

Canonical SMILES

N#CCC(=O)C1=CC=C(Cl)C(F)=C1

Other Names for this Substance

  • Benzenepropanenitrile, 4-chloro-3-fluoro-β-oxo-
  • 4-Chloro-3-fluoro-β-oxobenzenepropanenitrile
  • 3-(4-Chloro-3-fluorophenyl)-3-oxopropanenitrile