Imidazole, 2,5-dimethyl-4-phenyl-, hydrochloride
Basic information
- CAS
40405-82-1- Standard SMILES
Cc1nc(-c2ccccc2)c(C)[nH]1.Cl- InChIKey
OLPXJJIRGMATLF-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2
- Average molar mass
- 208.69 g/mol
- Monoisotopic mass
- 208.0767261
Names & identifiers
- Preferred name
- Imidazole, 2,5-dimethyl-4-phenyl-, hydrochloride
- IUPAC
- 2,5-dimethyl-4-phenyl-1H-imidazole;hydrochloride
Names & synonyms
Imidazole, 2,5-dimethyl-4-phenyl-, hydrochloride40405-82-12,5-Dimethyl-4-phenylimidazole hydrochloride2,5-Dimethyl-4-phenylimidazol hydrochlorid [German]2,5-Dimethyl-4-phenylimidazol hydrochlorid1H-Imidazole, 2,4-dimethyl-5-phenyl-, monohydrochlorideDTXSID00193421RefChem:348848DTXCID101159122,5-Dimethyl-4-phenyl-1H-imidazole--hydrogen chloride (1/1)
Database identifiers
- CAS
40405-82-1- PubChem CID
- 218259
- DTXSID
DTXSID00193421
Properties
Computed structural properties
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
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Compound notes
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