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CAS Number: 60555-93-3
6-bromo-2,3-dimethoxybenzoic acid

Structure

6-bromo-2,3-dimethoxybenzoic acid
Name: 6-bromo-2,3-dimethoxybenzoic acid
Synonyms:
General Information
Product Number: 60555933

CAS Registry Number 60555-93-3
Name:
Benzoic acid, 6-​bromo-​2,​3-​dimethoxy-
2,3-Dimethoxy-6-bromobenzoic acid
2-Bromo-5,6-dimethoxybenzoic acid
6-Bromo-2,3-dimethoxybenzoic 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/c1-13-6-4-3-5(10)7(9(11)12)8(6)14-2/h3-4H,1-2H3,(H,11,12)

InChI Key:AJANRRXNCDJJFF-UHFFFAOYSA-N

Canonical SMILES:COC1=C(C(=C(C=C1)Br)C(=O)O)OC

 

Thermal Properties Value Condition Note
Melting Point 109-110 °C   (1)CAS
Melting Point 87-89 °C Solv: benzene (71-43-2); ligroine (8032-32-4) (3)CAS

Specification

98%

References
  1. (1) Konno, Fujiko; Journal of Organic Chemistry 2006, V71(26), P9818-9823 CAPLUS
  2. (3) Pettit, George R.; Journal of Organic Chemistry 1960, V25, P721-5 CAPLUS
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