3-Bromo-4-hydroxy-5-methoxybenzoic acid

CAS Registry Number®

6324-52-3
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CAS Name

3-Bromo-4-hydroxy-5-methoxybenzoic acid

Molecular Formula

C8H7BrO4

Molecular Mass

247.04

Cite this Page

3-Bromo-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=6324-52-3 (retrieved 2024-09-07) (CAS RN: 6324-52-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    221 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H7BrO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12)

InChIKey

InChIKey=FGOVBTMEPVEFCJ-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 3-bromo-4-hydroxy-5-methoxy-
  • Vanillic acid, 5-bromo-
  • 3-Bromo-4-hydroxy-5-methoxybenzoic acid
  • 5-Bromovanillic acid
  • NSC 29084