CAS Registry Number: 35450-37-4

Name:

Benzoic acid, 3-​bromo-​4-​methoxy-​, methyl ester
p-​Anisic acid, 3-​bromo-​, methyl ester (6CI); 3-​Bromo-​4-​methoxybenzoic acid methyl ester; Methyl 3-​bromo-​4-​methoxybenzoate; Methyl 3-​bromoanisate 

Chemical Formula: C9H9BrO3
Exact Mass: 243.97
Molecular Weight: 245.07
m/z: 243.97 (100.0%), 245.97 (97.3%), 244.98 (10.0%), 246.97 (9.5%), 245.98 (1.1%), 247.98 (1.0%)
Elemental Analysis: C, 44.11; H, 3.70; Br, 32.60; O, 19.59

InChI: InChI=1S/C9H9BrO3/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5H,1-2H3
InChIKey: ZREVPFANJBZHEU-UHFFFAOYSA-N
Canonical SMILES : COC1=C(C=C(C=C1)C(=O)OC)Br

Specification

98%

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3. (3) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
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