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CAS Number: 174913-09-8
1-bromo-4-chloro-2-methoxybenzene

Structure

1-bromo-4-chloro-2-methoxybenzene
Name: 1-bromo-4-chloro-2-methoxybenzene
Synonyms:
General Information
Product Number: 174913098
CAS Registry Number: 174913-09-8
Name:
        Benzene, 1-​bromo-​4-​chloro-​2-​methoxy-
        1-​Bromo-​4-​chloro-​2-​methoxybenzene; 2-​Bromo-​5-​chloroanisole 
 
Chemical Formula: C7H6BrClO
Exact Mass: 219.93
Molecular Weight: 221.48
m/z: 221.93 (100.0%), 219.93 (77.3%), 223.92 (24.0%), 222.93 (7.7%), 220.93 (5.9%), 224.93 (1.9%)
Elemental Analysis: C, 37.96; H, 2.73; Br, 36.08; Cl, 16.01; O, 7.22
 
InChI: InChI=1S/C7H6BrClO/c1-10-7-4-5(9)2-3-6(7)8/h2-4H,1H3
InChIKey: CQGYLDZGJLVLMK-UHFFFAOYSA-N
Canonical SMILES : COC1=C(C=CC(=C1)Cl)Br

Specification

98%

References
  1. (1) Kakinuma, Hiroyuki; Journal of Medicinal Chemistry 2010, V53(8), P3247-3261 CAPLUS
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