Basic information
- CAS
65657-53-6- Standard SMILES
O=C(Cl)n1c(=O)[nH]c2ccccc21- InChIKey
WPWFNAFNXXIJRV-UHFFFAOYSA-N- Molecular formula
- C8H5ClN2O2
- Average molar mass
- 196.59 g/mol
- Monoisotopic mass
- 196.0039551
Names & identifiers
- Preferred name
- 2,3-dihydro-2-oxo-1H-benzimidazol-1-ylcarbonyl chloride
- IUPAC
- 2-oxo-3H-benzimidazole-1-carbonyl chloride
- English name
- 1H-Benzimidazole-1-carbonyl chloride, 2,3-dihydro-2-oxo- (9CI)
- Molecular formula
- C8H5ClN2O2
- Molecular weight
- 196.59
Names & synonyms
65657-53-62-Oxo-2,3-dihydro-1H-benzo[d]imidazole-1-carbonyl chloride2,3-dihydro-2-oxo-1H-benzimidazol-1-ylcarbonyl chlorideSCHEMBL2924922DTXSID60442068WPWFNAFNXXIJRV-UHFFFAOYSA-NMFCD18807727SY4214152-Oxobenzimidazole-1-Carboxylic Acid Chloride2,3-Dihydro-2-oxo-1H-benzimidazole-1-carbonyl chloride2-oxo-2,3-dihydro-1h-benzimidazole-1-carbonyl chloride2-Oxo-2,3-dihydro-1H-1,3-benzimidazole-1-carbonyl chloride
Show more names
1H-Benzimidazole-1-carbonyl chloride, 2,3-dihydro-2-oxo-1H-Benzimidazole-1-carbonyl chloride, 2,3-dihydro-2-oxo- (9CI)
Database identifiers
- CAS
65657-53-6- PubChem CID
- 10584064
- DTXSID
DTXSID60442068
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 257
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
9 records
Compound notes
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