2,4,6-Tris(trifluoromethyl)benzoic acid

CAS Registry Number®

25753-26-8

CAS Name

2,4,6-Tris(trifluoromethyl)benzoic acid

Molecular Formula

C10H3F9O2

Molecular Mass

326.12

Cite this Page

2,4,6-Tris(trifluoromethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25753-26-8 (retrieved 2024-11-22) (CAS RN: 25753-26-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    185-186 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C10H3F9O2/c11-8(12,13)3-1-4(9(14,15)16)6(7(20)21)5(2-3)10(17,18)19/h1-2H,(H,20,21)

InChIKey

InChIKey=AQXAOQFYVRCSBV-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C(F)(F)F)C=C(C(F)(F)F)C=C1C(F)(F)F

Canonical SMILES

O=C(O)C=1C(=CC(=CC1C(F)(F)F)C(F)(F)F)C(F)(F)F

Other Names for this Substance

  • Benzoic acid, 2,4,6-tris(trifluoromethyl)-
  • 2,4,6-Tris(trifluoromethyl)benzoic acid

CAS INSIGHTSTM
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