1-[3-Chloro-4-(trifluoromethoxy)phenyl]ethanone

CAS Registry Number®

129604-27-9
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CAS Name

1-[3-Chloro-4-(trifluoromethoxy)phenyl]ethanone

Molecular Formula

C9H6ClF3O2

Molecular Mass

238.59

Cite this Page

1-[3-Chloro-4-(trifluoromethoxy)phenyl]ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=129604-27-9 (retrieved 2024-04-29) (CAS RN: 129604-27-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    98-99 °C @ Press: 0.1 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H6ClF3O2/c1-5(14)6-2-3-8(7(10)4-6)15-9(11,12)13/h2-4H,1H3

InChIKey

InChIKey=BUSQQCHYIYPNTO-UHFFFAOYSA-N

SMILES

O(C(F)(F)F)C1=C(Cl)C=C(C(C)=O)C=C1

Canonical SMILES

O=C(C1=CC=C(OC(F)(F)F)C(Cl)=C1)C

Other Names for this Substance

  • Ethanone, 1-[3-chloro-4-(trifluoromethoxy)phenyl]-
  • 1-[3-Chloro-4-(trifluoromethoxy)phenyl]ethanone
  • 3-Chloro-4-trifluoromethoxyacetophenone

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