Basic information
- CAS
73778-93-5- Standard SMILES
Cn1c(=O)n(C)c2cc(Cl)c(N)cc21- InChIKey
OHMBJXFJECEHTK-UHFFFAOYSA-N- Molecular formula
- C9H10ClN3O
- Average molar mass
- 211.65 g/mol
- Monoisotopic mass
- 211.0512396
Names & identifiers
- Preferred name
- 5-Amino-6-chloro-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one
- IUPAC
- 5-amino-6-chloro-1,3-dimethylbenzimidazol-2-one
Names & synonyms
73778-93-5SCHEMBL14995348SCHEMBL30349855DTXSID9011748075-Amino-6-chloro-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one5-Amino-6-chloro-1,3-dihydro-1,3-dimethyl-2H-benzimidazol-2-oneMFCD07432829AKOS000297074SY4200425-Amino-6-chloro-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one
Database identifiers
- CAS
73778-93-5- PubChem CID
- 4771087
- DTXSID
DTXSID901174807
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 49.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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