Basic information
- CAS
4064-16-8- Standard SMILES
CCC1(c2ccccc2)CCOC1=O- InChIKey
TVRCQMFDVHKZHL-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- 3-Ethyl-3-phenyloxolan-2-one
- IUPAC
- 3-ethyl-3-phenyloxolan-2-one
Names & synonyms
3-ethyl-3-phenyloxolan-2-one4064-16-8DTXSID30961034RefChem:1067776DTXCID201388871alpha-Ethyl-alpha-phenyl-gamma-butyrolactoneBEFLBRN 01444005-Etylo-5-fenylo-beta-butyrolakton [Polish]5-Etylo-5-fenylo-beta-butyrolakton2(3H)-FURANONE, DIHYDRO-3-ETHYL-3-PHENYL-4-17-00-05003 (Beilstein Handbook Reference)
Show more names
SCHEMBL16915056
Database identifiers
- CAS
4064-16-8- PubChem CID
- 19986
- DTXSID
DTXSID30961034
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 218
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…