Basic information
- CAS
75802-91-4- Standard SMILES
ClC[n+]1c[nH]c2ccccc21.[Cl-]- InChIKey
ZILXDWJVIMOFAJ-UHFFFAOYSA-N- Molecular formula
- C8H8Cl2N2
- Average molar mass
- 203.07 g/mol
- Monoisotopic mass
- 202.0064537
Names & identifiers
- Preferred name
- Benzimidazole, 1-chloromethyl-, hydrochloride
- IUPAC
- 3-(chloromethyl)-1H-benzimidazol-3-ium chloride
Names & synonyms
1-Chloromethyl-benzimidazolehydrochlorideBENZIMIDAZOLE, 1-CHLOROMETHYL-, HYDROCHLORIDE
Database identifiers
- CAS
75802-91-4- PubChem CID
- 53353
Properties
Computed structural properties
- Topological polar surface area
- 19.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 140
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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