Basic information
- CAS
13990-66-4- Standard SMILES
C[N+](C)(C)Cc1ccccc1C(=O)c1ccccc1- InChIKey
TZFSAZCHGRJYAJ-UHFFFAOYSA-N- Molecular formula
- C17H20NO+
- Average molar mass
- 254.35 g/mol
- Monoisotopic mass
- 254.15448926
Names & identifiers
- Preferred name
- (2-Benzoylphenyl)-N,N,N-trimethylmethanaminium
- IUPAC
- (2-benzoylphenyl)methyl-trimethylazanium
Names & synonyms
13990-66-4NSC97454(2-Benzoylphenyl)-N,N,N-trimethylmethanaminiumSCHEMBL15272166DTXSID50329172NSC-97454
Database identifiers
- CAS
13990-66-4- PubChem CID
- 418008
- DTXSID
DTXSID50329172
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 1
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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