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CAS Number: 56518-42-4
4-bromo-3,5-dimethoxybenzoic acid

Structure

 4-bromo-3,5-dimethoxybenzoic acid
Name: 4-bromo-3,5-dimethoxybenzoic acid
Synonyms:
General Information
Product Number: 56518424

CAS Registry Number 56518-42-4
Name:
Benzoic acid, 4-?bromo-?3,?5-?dimethoxy-
4-Bromo-3,5-dimethoxybenzoic acid
3,5-Dimethoxy-4-bromobenzoic acid

 

Chemical Formula: C9H9BrO4
Exact Mass: 259.97
Molecular Weight: 261.07
m/z: 259.97 (100.0%), 261.97 (98.1%), 260.97 (10.0%), 262.97 (9.7%), 263.97 (1.2%)

 

InChI:InChI=1S/C9H9BrO4/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4H,1-2H3,(H,11,12)

InChI Key:JNFZULSIYYVRJO-UHFFFAOYSA-N

Canonical SMILES:COC1=CC(=CC(=C1Br)OC)C(=O)O

Specification

98%
References
  1. (2) Erdtman, Holger; Acta Chemica Scandinavica 1948, V2, P34-41 CAPLUS
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