2,3,4,5,6-Pentafluorobenzeneacetic acid

CAS Registry Number®

653-21-4
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CAS Name

2,3,4,5,6-Pentafluorobenzeneacetic acid

Molecular Formula

C8H3F5O2

Molecular Mass

226.10

Cite this Page

2,3,4,5,6-Pentafluorobenzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=653-21-4 (retrieved 2024-04-28) (CAS RN: 653-21-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    109 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15)

InChIKey

InChIKey=LGCODSNZJOVMHV-UHFFFAOYSA-N

SMILES

C(C(O)=O)C1=C(F)C(F)=C(F)C(F)=C1F

Canonical SMILES

O=C(O)CC=1C(F)=C(F)C(F)=C(F)C1F

Other Names for this Substance

  • Benzeneacetic acid, 2,3,4,5,6-pentafluoro-
  • Acetic acid, (pentafluorophenyl)-
  • 2,3,4,5,6-Pentafluorobenzeneacetic acid
  • (Pentafluorophenyl)acetic acid
  • 2,3,4,5,6-Pentafluorophenylacetic acid

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