Benzoic acid, 3-chloro-, methyl ester

CAS Registry Number®

2905-65-9

CAS Name

Benzoic acid, 3-chloro-, methyl ester

Molecular Formula

C8H7ClO2

Molecular Mass

170.59

Cite this Page

Benzoic acid, 3-chloro-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2905-65-9 (retrieved 2024-11-24) (CAS RN: 2905-65-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    231 °C

  • Melting Point (1)

    21 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3

InChIKey

InChIKey=XRDRKVPNHIWTBX-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC(Cl)=CC=C1

Canonical SMILES

O=C(OC)C=1C=CC=C(Cl)C1

Other Names for this Substance

  • Benzoic acid, 3-chloro-, methyl ester
  • Benzoic acid, m-chloro-, methyl ester
  • m-Chlorobenzoic acid methyl ester
  • Methyl m-chlorobenzoate
  • Methyl 3-chlorobenzoate

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