Basic information
- CAS
74386-45-1- Standard SMILES
CCCCCCCCCCCC[N+](C)(C)Cc1ccc(C(=O)c2ccccc2)cc1.[Br-]- InChIKey
IHUHYCRFWIKSJZ-UHFFFAOYSA-M- Molecular formula
- C28H42BrNO
- Average molar mass
- 488.5 g/mol
- Monoisotopic mass
- 487.24498
Names & identifiers
- Preferred name
- N-[(4-Benzoylphenyl)methyl]-N,N-dimethyldodecan-1-aminium bromide
- IUPAC
- (4-benzoylphenyl)methyl-dodecyl-dimethylazanium bromide
Names & synonyms
74386-45-1SCHEMBL11412610DTXSID20823016N-[(4-Benzoylphenyl)methyl]-N,N-dimethyldodecan-1-aminium bromide
Database identifiers
- CAS
74386-45-1- PubChem CID
- 71402011
- DTXSID
DTXSID20823016
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 15
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 444
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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