2-Chloro-β-oxo-3-(trifluoromethyl)benzenepropanenitrile

CAS Registry Number®

267881-04-9
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CAS Name

2-Chloro-β-oxo-3-(trifluoromethyl)benzenepropanenitrile

Molecular Formula

C10H5ClF3NO

Molecular Mass

247.60

Cite this Page

2-Chloro-β-oxo-3-(trifluoromethyl)benzenepropanenitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=267881-04-9 (retrieved 2024-08-24) (CAS RN: 267881-04-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C10H5ClF3NO/c11-9-6(8(16)4-5-15)2-1-3-7(9)10(12,13)14/h1-3H,4H2

InChIKey

InChIKey=QSOCHVYOYPYOJW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

N#CCC(=O)C1=CC=CC(=C1Cl)C(F)(F)F

Other Names for this Substance

  • Benzenepropanenitrile, 2-chloro-β-oxo-3-(trifluoromethyl)-
  • 2-Chloro-β-oxo-3-(trifluoromethyl)benzenepropanenitrile