Basic information
- Standard SMILES
CCCCCCCCCCCCCCn1cc[n+](-c2ccc(Cl)cc2)c1.[Br-]- InChIKey
MFFYUFBAXNWOEC-UHFFFAOYSA-M- Molecular formula
- C23H36BrClN2
- Average molar mass
- 455.9 g/mol
- Monoisotopic mass
- 454.17504
Names & identifiers
- Preferred name
- 1-(4-Chlorophenyl)-3-tetradecyl imidazolium bromide
- IUPAC
- 1-(4-chlorophenyl)-3-tetradecylimidazol-3-ium bromide
Names & synonyms
SCHEMBL1880771SCHEMBL18203176MFFYUFBAXNWOEC-UHFFFAOYSA-M1-(4-chlorophenyl)-3-tetradecyl imidazolium bromide
Database identifiers
- PubChem CID
- 86653178
Properties
Computed structural properties
- Topological polar surface area
- 8.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 14
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 328
Related reactions
1 records
Compound notes
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