4-(2-Chloroethyl)benzoic acid

CAS Registry Number®

20849-78-9

CAS Name

4-(2-Chloroethyl)benzoic acid

Molecular Formula

C9H9ClO2

Molecular Mass

184.62

Cite this Page

4-(2-Chloroethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=20849-78-9 (retrieved 2024-11-22) (CAS RN: 20849-78-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    187-188 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C9H9ClO2/c10-6-5-7-1-3-8(4-2-7)9(11)12/h1-4H,5-6H2,(H,11,12)

InChIKey

InChIKey=OOAPBGPLZAFZSO-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC=C(CCCl)C=C1

Canonical SMILES

O=C(O)C1=CC=C(C=C1)CCCl

Other Names for this Substance

  • Benzoic acid, 4-(2-chloroethyl)-
  • Benzoic acid, p-(2-chloroethyl)-
  • 4-(2-Chloroethyl)benzoic acid
  • 2-[4-Carboxyphenyl]ethyl chloride