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CAS Number: 39513-26-3
5-bromo-1H-benzo[d]imidazol-2(3H)-onev

Structure

5-bromo-1H-benzo[d]imidazol-2(3H)-onev
Name: 5-bromo-1H-benzo[d]imidazol-2(3H)-onev
Synonyms:
General Information
Product Number: 39513263

CAS Registry Number 39513-26-3
Name:
2H-?Benzimidazol-?2-?one, 5-?bromo-?1,?3-?dihydro-
2-Benzimidazolinone, 5-bromo- (6CI)
5-Bromo-1,3-dihydro-2H-benzimidazol-2-one
5-Bromo-1,3-dihydro-2H-benzo[d]imidazol-2-one
5-Bromo-1,3-dihydrobenzimidazol-2-one
5-Bromo-1H-benzimidazol-2(3H)-one

 

Chemical Formula: C7H5BrN2O
Exact Mass: 211.96
Molecular Weight: 213.03
m/z: 211.96 (100.0%), 213.96 (97.5%), 212.96 (8.4%), 214.96 (7.5%)

 

InChI:InChI=1S/C7H5BrN2O/c8-4-1-2-5-6(3-4)10-7(11)9-5/h1-3H,(H2,9,10,11)

InChI Key:VWIGEYVTDXNDHV-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1Br)NC(=O)N2

 

Thermal Properties Value Condition Note
Melting Point 336-337 °C Solv: acetic acid (64-19-7) (3)CAS
Melting Point 336-337 °C Solv: ethanol (64-17-5) (1)IC
Melting Point 315-316 °C (sublm)   (4)IC

Specification

98%

References
  1. (1) Eckstein, Zygmunt; Journal of Chemical and Engineering Data 1983, V28(2), P279-81 CAPLUS
  2. (3) Clark, Robert L.; Journal of the American Chemical Society 1958, V80, P1657-62 CAPLUS
  3. (4) Solomko, Z. F.; Voprosy Khimii i Khimicheskoi Tekhnologii 1975, V39, P93-8 CAPLUS
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