Benzoic acid, 3-(bromomethyl)-4-fluoro-, methyl ester

CAS Registry Number®

878744-25-3
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CAS Name

Benzoic acid, 3-(bromomethyl)-4-fluoro-, methyl ester

Molecular Formula

C9H8BrFO2

Molecular Mass

247.06

Cite this Page

Benzoic acid, 3-(bromomethyl)-4-fluoro-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=878744-25-3 (retrieved 2024-07-07) (CAS RN: 878744-25-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H8BrFO2/c1-13-9(12)6-2-3-8(11)7(4-6)5-10/h2-4H,5H2,1H3

InChIKey

InChIKey=LJNYXXWIWSCHKW-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC(CBr)=C(F)C=C1

Canonical SMILES

O=C(OC)C1=CC=C(F)C(=C1)CBr

Other Names for this Substance

  • Benzoic acid, 3-(bromomethyl)-4-fluoro-, methyl ester
  • Methyl 3-(bromomethyl)-4-fluorobenzoate
  • 3-Bromomethyl-4-fluorobenzoic acid methyl ester