CAS Registry Number: 72517-23-8

Name:

Benzoic acid, 5-​bromo-​2,​3-​dimethoxy-
5-​Bromo-​2,​3-​dimethoxybenzoic acid; NSC 281247 

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%)
Elemental Analysis: C, 41.41; H, 3.47; Br, 30.61; O, 24.51

InChI: InChI=1S/C9H9BrO4/c1-13-7-4-5(10)3-6(9(11)12)8(7)14-2/h3-4H,1-2H3,(H,11,12)
InChIKey: ZKMWQUDSDYOEJQ-UHFFFAOYSA-N
Canonical SMILES : COC1=C(C(=CC(=C1)Br)C(=O)O)OC

Specification

98%

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