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CAS Number: 31574-87-5
2,8-dibromodibenzo[b,d]thiophene

Structure

2,8-dibromodibenzo[b,d]thiophene
Name: 2,8-dibromodibenzo[b,d]thiophene
Synonyms:
General Information
Product Number: 31574875

CAS Registry Number 31574-87-5
Name:
Dibenzothiophene, 2,​8-​dibromo-
2,8-Dibromodibenzo[b,d]thiophene
2,8-Dibromodibenzothiophene

 

Chemical Formula: C12H6Br2S
Exact Mass: 339.86
Molecular Weight: 342.05
m/z: 341.85 (100.0%), 343.85 (52.0%), 339.86 (50.2%), 342.86 (12.8%), 344.85 (7.1%), 340.86 (7.0%), 345.85 (2.2%), 342.85 (1.1%)

 

InChI:InChI=1S/C12H6Br2S/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6H

InChI Key:WNEXSUAHKVAPFK-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Br)C3=C(S2)C=CC(=C3)Br

 

Thermal Properties Value Condition Note
Melting Point 223-224 °C   (9)CAS
Melting Point See full text   (10)CAS

Specification

98%

References
  1. (9) Gilman, Henry; Journal of the American Chemical Society 1951, V73, P4982-3 CAPLUS
  2. (10) Andrews, M. D.; Science of Synthesis 2001, V10, P211-263 CAPLUS
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