5,5-Dimethyl-4-phenyldihydrofuran-2(3h)-one
Basic information
- CAS
13133-96-5- Standard SMILES
CC1(C)OC(=O)CC1c1ccccc1- InChIKey
CULAWTLHZMUYLR-UHFFFAOYSA-N- Molecular formula
- C12H14O2
- Average molar mass
- 190.24 g/mol
- Monoisotopic mass
- 190.09937969
Names & identifiers
- Preferred name
- 5,5-Dimethyl-4-phenyldihydrofuran-2(3h)-one
- IUPAC
- 5,5-dimethyl-4-phenyloxolan-2-one
Names & synonyms
13133-96-55,5-dimethyl-4-phenyldihydrofuran-2(3h)-oneNSC108984SCHEMBL10748346NSC-108984
Database identifiers
- CAS
13133-96-5- PubChem CID
- 268671
- Nikkaji
- J822.929E
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 226
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…