Basic information
- CAS
1825392-05-9- Standard SMILES
O.O=C1C(=O)C(c2ccccc2)Oc2cc(O)ccc21- InChIKey
DLRRAKLLRRAMTM-UHFFFAOYSA-N- Molecular formula
- C15H12O5
- Average molar mass
- 272.25 g/mol
- Monoisotopic mass
- 272.06847348
Names & identifiers
- Preferred name
- 3,7-Dihydroxy-2-phenyl-4H-chromen-4-one hydrate (1:1)
- IUPAC
- 7-hydroxy-2-phenylchromene-3,4-dione;hydrate
Names & synonyms
DTXSID101383404MFCD002095773,7-Dihydroxy-2-phenyl-4H-chromen-4-one hydrate (1:1)2H-1-Benzopyran-3,4-dione, 7-hydroxy-2-phenyl-, hydrate (1:1)1825392-05-9
Database identifiers
- CAS
1825392-05-9- PubChem CID
- 175683868
- DTXSID
DTXSID101383404
Properties
Computed structural properties
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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