4-Bromo-2-fluorobenzoic acid

CAS Registry Number®

112704-79-7

CAS Name

4-Bromo-2-fluorobenzoic acid

Molecular Formula

C7H4BrFO2

Molecular Mass

219.01

Cite this Page

4-Bromo-2-fluorobenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=112704-79-7 (retrieved 2024-11-24) (CAS RN: 112704-79-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    204-208 °C (polymorph)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H4BrFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)

InChIKey

InChIKey=ZQQSRVPOAHYHEL-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(F)C=C(Br)C=C1

Canonical SMILES

O=C(O)C1=CC=C(Br)C=C1F

Other Names for this Substance

  • Benzoic acid, 4-bromo-2-fluoro-
  • 4-Bromo-2-fluorobenzoic acid
  • 2-Fluoro-4-bromobenzoic acid
  • NSC 190364