Basic information
- CAS
109485-44-1- Standard SMILES
CC(c1cccc(Cl)c1)n1ccnc1- InChIKey
WNNPJMRGQLWERS-UHFFFAOYSA-N- Molecular formula
- C11H11ClN2
- Average molar mass
- 206.67 g/mol
- Monoisotopic mass
- 206.0610761
Names & identifiers
- Preferred name
- 1-(3-Chlorophenyl)-1-(1-imidazolyl)-ethane
- IUPAC
- 1-[1-(3-chlorophenyl)ethyl]imidazole
Names & synonyms
1-(3-chlorophenyl)-1-(1-imidazolyl)-ethane109485-44-1SCHEMBL9748243WNNPJMRGQLWERS-UHFFFAOYSA-NDTXSID8012771451-[1-(3-Chlorophenyl)ethyl]-1H-imidazole
Database identifiers
- CAS
109485-44-1- PubChem CID
- 19902091
- DTXSID
DTXSID801277145
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 186
Related reactions
3 records
Compound notes
Loading…