3-Chloro-4-fluoro-2-methylbenzoic acid

CAS Registry Number®

154257-77-9
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CAS Name

3-Chloro-4-fluoro-2-methylbenzoic acid

Molecular Formula

C8H6ClFO2

Molecular Mass

188.58

Cite this Page

3-Chloro-4-fluoro-2-methylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=154257-77-9 (retrieved 2024-09-08) (CAS RN: 154257-77-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    180-182 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H6ClFO2/c1-4-5(8(11)12)2-3-6(10)7(4)9/h2-3H,1H3,(H,11,12)

InChIKey

InChIKey=FMNNDKWURCANLD-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-chloro-4-fluoro-2-methyl-
  • 3-Chloro-4-fluoro-2-methylbenzoic acid