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CAS Number: 139937-37-4
4-bromo-2-methylbenzene-1-sulfonyl chloride

Structure

4-bromo-2-methylbenzene-1-sulfonyl chloride
Name: 4-bromo-2-methylbenzene-1-sulfonyl chloride
Synonyms:
General Information
Product Number: 139937374

CAS Registry Number 139937-37-4
Name:
Benzenesulfonyl chloride, 4-​bromo-​2-​methyl-
2-Methyl-4-bromobenzenesulfonyl chloride
4-Bromo-2-methylbenzene-1-sulfonyl chloride
4-Bromo-2-methylbenzenesulfonyl chloride

 

Chemical Formula: C7H6BrClO2S
Exact Mass: 267.90
Molecular Weight: 269.54
m/z: 269.89 (100.0%), 267.90 (74.8%), 271.89 (27.6%), 270.90 (7.7%), 268.90 (6.4%), 272.89 (2.3%), 273.89 (1.1%)

 

InChI:InChI=1S/C7H6BrClO2S/c1-5-4-6(8)2-3-7(5)12(9,10)11/h2-4H,1H3

InChI Key:KNBSFUSBZNMAKU-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C=CC(=C1)Br)S(=O)(=O)Cl

 

Thermal Properties Value Condition Note
Melting Point 63-64 °C   (1)CAS

Specification

98%

References
  1. (1) Chen, Qiao-Hong; Bioorganic & Medicinal Chemistry 2005, V13(7), P2459-2468 CAPLUS
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