Ethyl α,α-difluoro-4-(trifluoromethyl)benzeneacetate

CAS Registry Number®

73789-96-5
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CAS Name

Ethyl α,α-difluoro-4-(trifluoromethyl)benzeneacetate

Molecular Formula

C11H9F5O2

Molecular Mass

268.18

Cite this Page

Ethyl α,α-difluoro-4-(trifluoromethyl)benzeneacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=73789-96-5 (retrieved 2024-09-06) (CAS RN: 73789-96-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    83-84 °C @ Press: 5 Torr

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C11H9F5O2/c1-2-18-9(17)10(12,13)7-3-5-8(6-4-7)11(14,15)16/h3-6H,2H2,1H3

InChIKey

InChIKey=CRTRDMJXYPHFPE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzeneacetic acid, α,α-difluoro-4-(trifluoromethyl)-, ethyl ester
  • Ethyl α,α-difluoro-4-(trifluoromethyl)benzeneacetate
  • 2-(4-Trifluoromethylphenyl)-2,2-difluoroacetic acid ethyl ester
  • Ethyl 2,2-difluoro-2-(4-(trifluoromethyl)phenyl)acetate