Basic information
- CAS
73991-96-5- Standard SMILES
O=C1OCC[C@@H]1OCOCc1ccccc1- InChIKey
QDPKFXAXDKTNTM-NSHDSACASA-N- Molecular formula
- C12H14O4
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.08920892
Names & identifiers
- Preferred name
- 2(3H)-Furanone, dihydro-3-[(phenylmethoxy)methoxy]-, (S)-
- IUPAC
- (3S)-3-(phenylmethoxymethoxy)oxolan-2-one
Names & synonyms
73991-96-52(3H)-Furanone, dihydro-3-[(phenylmethoxy)methoxy]-, (S)-DTXSID90455444(3S)-3-[(BENZYLOXY)METHOXY]OXOLAN-2-ONE
Database identifiers
- CAS
73991-96-5- PubChem CID
- 11106942
- DTXSID
DTXSID90455444
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 223
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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