Basic information
- CAS
40117-49-5- Standard SMILES
O=C1c2ccc(O)cc2C(=O)C1c1ccccc1- InChIKey
JYYLRIZQBCBOBN-UHFFFAOYSA-N- Molecular formula
- C15H10O3
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.06299418
Names & identifiers
- Preferred name
- 5-Hydroxy-2-phenyl-1H-indene-1,3(2H)-dione
- IUPAC
- 5-hydroxy-2-phenylindene-1,3-dione
Names & synonyms
5-Hydroxy-2-phenyl-1H-indene-1,3(2H)-dione40117-49-5DTXSID70960561RefChem:1072985DTXCID9013884101,3-Indandione, 5-hydroxy-2-phenyl-
Database identifiers
- CAS
40117-49-5- PubChem CID
- 218062
- DTXSID
DTXSID70960561
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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