N,N,N-Triethyl-5-oxo-4,5-diphenylpentan-1-aminium iodide
Basic information
- CAS
38940-50-0- Standard SMILES
CC[N+](CC)(CC)CCCC(C(=O)c1ccccc1)c1ccccc1.[I-]- InChIKey
AYFCBVIQWBWGRB-UHFFFAOYSA-M- Molecular formula
- C23H32INO
- Average molar mass
- 465.4 g/mol
- Monoisotopic mass
- 465.15286
Names & identifiers
- Preferred name
- N,N,N-Triethyl-5-oxo-4,5-diphenylpentan-1-aminium iodide
- IUPAC
- triethyl-(5-oxo-4,5-diphenylpentyl)azanium iodide
Names & synonyms
38940-50-0DTXSID40959780N,N,N-triethyl-5-oxo-4,5-diphenylpentan-1-aminium iodideRefChem:1090337DTXCID701387654(4-Benzoyl-4-phenylbutyl)triethylammonium iodideBenzoin, deoxy(alpha-(3-triethylammonio)propyl)-, iodideAMMONIUM, (4-BENZOYL-4-PHENYLBUTYL)TRIETHYL-, IODIDE
Database identifiers
- CAS
38940-50-0- PubChem CID
- 38182
- DTXSID
DTXSID40959780
Properties
Computed structural properties
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 367
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Compound notes
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