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CAS Number: 2516-40-7
2-bromobenzo[d]thiazole

Structure

2-bromobenzo[d]thiazole
Name: 2-bromobenzo[d]thiazole
Synonyms:
General Information
Product Number: 2516407

CAS Registry Number 2516-40-7
Name:
Benzothiazole, 2-​bromo-
2-Bromo-1,3-benzothiazole
2-Bromobenzo[d]thiazole
2-Bromobenzothiazole

 

Chemical Formula: C7H4BrNS
Exact Mass: 212.92
Molecular Weight: 214.08
m/z: 214.92 (100.0%), 212.92 (98.2%), 213.93 (7.5%), 215.93 (7.3%), 216.92 (4.4%), 215.92 (1.5%), 213.92 (1.1%)

 

InChI:InChI=1S/C7H4BrNS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H

InChI Key:DRLMMVPCYXFPEP-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)N=C(S2)Br

 

Thermal Properties Value Condition Note
Melting Point 95 °C (decomp)   (3)CAS
Melting Point 39-40 °C   (4)CAS

Specification

98%

References

(3) Mizuno, Yoshihisa; Pharmaceutical Bulletin 1953, V1, P319-22 CAPLUS

(4) Lee, Young Min; Tetrahedron 2010, V66(37), P7418-7422 CAPLUS

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