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CAS Number: 942473-86-1
4-bromo-3-fluorobenzenethiol

Structure

4-bromo-3-fluorobenzenethiol
Name: 4-bromo-3-fluorobenzenethiol
Synonyms:
General Information
Product Number: 942473861
CAS Registry Number:
942473-86-1
Name:
Benzenethiol, 4-bromo-3-fluoro-
4-Bromo-3-fluorobenzenethiol 
 
Chemical Formula: C6H4BrFS
Exact Mass: 205.92
Molecular Weight: 207.06
m/z: 207.92 (100.0%), 205.92 (98.2%), 208.92 (7.3%), 206.92 (7.2%), 209.91 (4.3%)
Elemental Analysis: C, 34.80; H, 1.95; Br, 38.59; F, 9.18; S, 15.49
 
InChI: InChI=1S/C6H4BrFS/c7-5-2-1-4(9)3-6(5)8/h1-3,9H
InChIKey: QWSUMJXRROQYPN-UHFFFAOYSA-N
Canonical SMILES : C1=CC(=C(C=C1S)F)Br

Specification

98%

References

Jpn. Kokai Tokkyo Koho (2013), JP 2013107855 A 20130606. 

PCT Int. Appl. (2011), WO 2011148922 A1 20111201.

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