Basic information
- CAS
112258-52-3- Standard SMILES
CC(CCl)n1ccnc1- InChIKey
OLKVVTMPCRPSJP-UHFFFAOYSA-N- Molecular formula
- C6H9ClN2
- Average molar mass
- 144.6 g/mol
- Monoisotopic mass
- 144.045426
Names & identifiers
- Preferred name
- 1-(1-Chloropropan-2-yl)-1H-imidazole
- IUPAC
- 1-(1-chloropropan-2-yl)imidazole
Names & synonyms
112258-52-3DTXSID4012780721-(1-Chloropropan-2-yl)-1H-imidazole1-(2-Chloro-1-methylethyl)-1H-imidazole
Database identifiers
- CAS
112258-52-3- PubChem CID
- 85538657
- DTXSID
DTXSID401278072
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 87.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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