Benzoic acid, 3,4-dichloro-, ethyl ester

CAS Registry Number®

28394-58-3
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CAS Name

Benzoic acid, 3,4-dichloro-, ethyl ester

Molecular Formula

C9H8Cl2O2

Molecular Mass

219.06

Cite this Page

Benzoic acid, 3,4-dichloro-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=28394-58-3 (retrieved 2024-09-06) (CAS RN: 28394-58-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    137-139 °C @ Press: 10 Torr

  • Melting Point (2)

    37.2-37.7 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H8Cl2O2/c1-2-13-9(12)6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3

InChIKey

InChIKey=YONQPSPHUKKUEJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3,4-dichloro-, ethyl ester
  • Ethyl 3,4-dichlorobenzoate
  • 3,4-Dichlorobenzoic acid ethyl ester