Basic information
- CAS
7463-99-2- Standard SMILES
O=C(O)C1(Cc2ccccc2)CC(c2ccccc2)OC1=O- InChIKey
FXGFQFISUNYCMZ-UHFFFAOYSA-N- Molecular formula
- C18H16O4
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.10485899
Names & identifiers
- Preferred name
- 3-Benzyl-2-oxo-5-phenyloxolane-3-carboxylic acid
- IUPAC
- 3-benzyl-2-oxo-5-phenyloxolane-3-carboxylic acid
Names & synonyms
7463-99-23-benzyl-2-oxo-5-phenyloxolane-3-carboxylic acidNSC404768DTXSID10323737NSC-404768
Database identifiers
- CAS
7463-99-2- PubChem CID
- 346512
- DTXSID
DTXSID10323737
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 421
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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