4-Phenoxy-1-phenylbutane-1,3-dione
Basic information
- CAS
83229-03-2- Standard SMILES
O=C(COc1ccccc1)CC(=O)c1ccccc1- InChIKey
ULVXIDVBBDENGZ-UHFFFAOYSA-N- Molecular formula
- C16H14O3
- Average molar mass
- 254.28 g/mol
- Monoisotopic mass
- 254.0942943
Names & identifiers
- Preferred name
- 4-Phenoxy-1-phenylbutane-1,3-dione
- IUPAC
- 4-phenoxy-1-phenylbutane-1,3-dione
Names & synonyms
4-PHENOXY-1-PHENYLBUTANE-1,3-DIONECTK2I631383229-03-2DTXSID70437268
Database identifiers
- CAS
83229-03-2- PubChem CID
- 10244028
- DTXSID
DTXSID70437268
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 299
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Compound notes
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