Basic information
- CAS
116137-49-6- Standard SMILES
CC(C)(C)Cn1cncc1-c1ccc(Cl)cc1- InChIKey
UXSOEOFBQJZAHH-UHFFFAOYSA-N- Molecular formula
- C14H17ClN2
- Average molar mass
- 248.75 g/mol
- Monoisotopic mass
- 248.1080262
Names & identifiers
- Preferred name
- 5-(4-Chlorophenyl)-1-(2,2-dimethylpropyl)imidazole
- IUPAC
- 5-(4-chlorophenyl)-1-(2,2-dimethylpropyl)imidazole
Names & synonyms
5-(4-chlorophenyl)-1-(2,2-dimethylpropyl)imidazole116137-49-65-(4-chlorophenyl)-1-(2,2-dimethylpropyl)-1h-imidazoleDTXSID00151288
Database identifiers
- CAS
116137-49-6- PubChem CID
- 189352
- DTXSID
DTXSID00151288- Nikkaji
- J412.553C
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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