2-(4-Hydroxy-3-methoxyphenyl)-2,3-dihydrochromen-4-one
Basic information
- CAS
5438-64-2- Standard SMILES
COc1cc(C2CC(=O)c3ccccc3O2)ccc1O- InChIKey
CZYGRTLVTPFBHU-UHFFFAOYSA-N- Molecular formula
- C16H14O4
- Average molar mass
- 270.28 g/mol
- Monoisotopic mass
- 270.08920892
Names & identifiers
- Preferred name
- 2-(4-Hydroxy-3-methoxyphenyl)-2,3-dihydrochromen-4-one
- IUPAC
- 2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydrochromen-4-one
- English name
- 4'-HYDROXY-3'-METHOXYFLAVANONE
- Molecular formula
- C16H14O4
- Molecular weight
- 270.28
Names & synonyms
NSC16721CHEMBL502107NSC-167212-(4-hydroxy-3-methoxyphenyl)-2,3-dihydrochromen-4-oneFLAVANONE, 4'-HYDROXY-3'-METHOXY2-(4-hydroxy-3-methoxy-phenyl)chroman-4-oneSCHEMBL5084433BDBM50488650XH1828354'-HYDROXY-3'-METHOXYFLAVANONE
Database identifiers
- CAS
5438-64-2- PubChem CID
- 226342
- ChEMBL
CHEMBL502107
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 356
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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