3-Chloro-4-hydroxy-5-methoxybenzoic acid

CAS Registry Number®

62936-23-6

CAS Name

3-Chloro-4-hydroxy-5-methoxybenzoic acid

Molecular Formula

C8H7ClO4

Molecular Mass

202.59

Cite this Page

3-Chloro-4-hydroxy-5-methoxybenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=62936-23-6 (retrieved 2024-11-23) (CAS RN: 62936-23-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    244-245 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H7ClO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12)

InChIKey

InChIKey=XBRYEHVBBMSSCG-UHFFFAOYSA-N

SMILES

O(C)C1=CC(C(O)=O)=CC(Cl)=C1O

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-chloro-4-hydroxy-5-methoxy-
  • Vanillic acid, 5-chloro-
  • 3-Chloro-4-hydroxy-5-methoxybenzoic acid
  • 5-Chlorovanillic acid
  • NSC 45930

CAS INSIGHTSTM
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