Basic information
- CAS
79316-64-6- Standard SMILES
COc1cc(O)c(C2=C(O)C(=O)CC2)c(OC)c1- InChIKey
FOWLGWOZRGRYQX-UHFFFAOYSA-N- Molecular formula
- C13H14O5
- Average molar mass
- 250.25 g/mol
- Monoisotopic mass
- 250.08412354
Names & identifiers
- Preferred name
- 2-Hydroxy-3-(2-hydroxy-4,6-dimethoxyphenyl)cyclopent-2-en-1-one
- IUPAC
- 2-hydroxy-3-(2-hydroxy-4,6-dimethoxyphenyl)cyclopent-2-en-1-one
Names & synonyms
79316-64-62-hydroxy-3-(2-hydroxy-4,6-dimethoxyphenyl)cyclopent-2-en-1-oneDTXSID7010003892-Cyclopenten-1-one, 2-hydroxy-3-(2-hydroxy-4,6-dimethoxyphenyl)-
Database identifiers
- CAS
79316-64-6- PubChem CID
- 187002
- DTXSID
DTXSID701000389
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 76 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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