Basic information
- CAS
63765-86-6- Standard SMILES
CCC(=O)C(c1ccccc1)(c1ccccc1)C(C)C[N+](C)(C)C.[Cl-]- InChIKey
YWYPAAYCGZXQOQ-UHFFFAOYSA-M- Molecular formula
- C22H30ClNO
- Average molar mass
- 359.9 g/mol
- Monoisotopic mass
- 359.2015923
Names & identifiers
- Preferred name
- 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride
- IUPAC
- trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium chloride
Names & synonyms
63765-86-63-HEXANONE, 5-(N,N-DIMETHYLAMINO)METHYL-4,4-DIPHENYL-, METHYLCHLORIDERefChem:10679056-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanone methochlorideDTXSID70980305N,N,N,2-Tetramethyl-4-oxo-3,3-diphenylhexan-1-aminium chloride
Database identifiers
- CAS
63765-86-6- PubChem CID
- 44684
- DTXSID
DTXSID70980305
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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