Basic information
- CAS
7495-60-5- Standard SMILES
CCCC(=O)NC(Cc1ccccc1)C(=O)CCC- InChIKey
VTKCMXPVSJHHRK-UHFFFAOYSA-N- Molecular formula
- C16H23NO2
- Average molar mass
- 261.36 g/mol
- Monoisotopic mass
- 261.17287898
Names & identifiers
- Preferred name
- N-(3-oxo-1-phenylhexan-2-yl)butanamide
- IUPAC
- N-(3-oxo-1-phenylhexan-2-yl)butanamide
Names & synonyms
7495-60-5N-(3-oxo-1-phenylhexan-2-yl)butanamideNSC407740DTXSID00324814NSC-407740
Database identifiers
- CAS
7495-60-5- PubChem CID
- 348449
- DTXSID
DTXSID00324814
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 282
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…