Basic information
- CAS
77298-64-7- Standard SMILES
O=c1cc(-c2ccccc2)oc2c(O)cccc12- InChIKey
XNUMOPPRKAGFPF-UHFFFAOYSA-N- Molecular formula
- C15H10O3
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.06299418
Overview
An 8-hydroxyflavone is a hydroxyflavone.
Names & identifiers
- Preferred name
- 8-Hydroxyflavone
- IUPAC
- 8-hydroxy-2-phenylchromen-4-one
- English name
- 8-Hydroxyflavone
- Molecular formula
- C15H10O3
- Molecular weight
- 238.24
Names & synonyms
8-HydroxyflavoneRefChem:91458777298-64-78-hydroxy-2-phenyl-4H-chromen-4-one8-hydroxy-2-phenylchromen-4-one8-Hydroxy-2-phenyl-4H-1-benzopyran-4-oneBRN 0384187FLAVONE, 8-HYDROXY-4H-1-Benzopyran-4-one, 8-hydroxy-2-phenyl-an 8-hydroxyflavone4H-1-Benzopyran-4-one, 8-hydroxy-2-phenyl- (9CI)CHEMBL144929
Show more names
SCHEMBL8934600DTXSID70228017CHEBI:192819XNUMOPPRKAGFPF-UHFFFAOYSA-N8-Hydroxy-2-phenyl-chromen-4-oneAKOS015906502DB-350904
Database identifiers
- CAS
77298-64-7- PubChem CID
- 53645
- DTXSID
DTXSID70228017- ChEMBL
CHEMBL144929- ChEBI
CHEBI:192819- Nikkaji
- J126.064B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 355
Experimental & physicochemical properties
LogP3.03
Physicochemical properties
- Melting point
- 249 · 249-250 °C
- Boiling point
- 425 · 425.0±45.0 °C(Predicted)
- Density
- 1.34 · 1.340±0.06 g/cm3(Predicted)
- pka
- 8.04 · 8.04±0.40(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: An 8-hydroxyflavone is a hydroxyflavone.
Related reactions
2 records
Compound notes
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