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CAS Number: 87120-81-8
2H-benzo[d]imidazol-2-one

Structure

2H-benzo[d]imidazol-2-one
Name: 2H-benzo[d]imidazol-2-one
Synonyms:
General Information
Product Number: 87120818

CAS Registry Number 87120-81-8
Name:
1-​Piperidinecarboxylic acid, 4-​(2,​3-​dihydro-​2-​oxo-​1H-​benzimidazol-​1-​yl)​-​, 1,​1-​dimethylethyl ester
1-[1-(tert-Butoxycarbonyl)-4-piperidinyl]-1,3-dihydro-2H-benzimidazole-2-one
4-(2-Oxo-2,3-dihydrobenzimidazol-1-yl)piperidine-1-carboxylic acid tert-butyl ester

 

Chemical Formula: C7H4N2O
Exact Mass: 132.03
Molecular Weight: 132.12
m/z: 132.03 (100.0%), 133.04 (7.7%)

 

InChI:InChI=1S/C17H23N3O3/c1-17(2,3)23-16(22)19-10-8-12(9-11-19)20-14-7-5-4-6-13(14)18-15(20)21/h4-7,12H,8-11H2,1-3H3,(H,18,21)

InChI Key:STEAYGPTLHZMJU-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)OC(=O)N1CCC(CC1)N2C3=CC=CC=C3NC2=O

 

Thermal Properties Value Condition Note
Melting Point 165.5-166.0 °C   (3)IC
Melting Point 156-159 °C   (1)CAS

Specification

98%

References
  1. (1) Kuethe, Jeffrey T.; Tetrahedron 2007, V63(46), P11489-11502 CAPLUS
  2. (3) Obase, Hiroyuki; Journal of Heterocyclic Chemistry 1983, V20(3), P565-73 CAPLUS
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