Basic information
- CAS
1840-02-4- Standard SMILES
O=C1CC(c2ccc(F)cc2)Oc2ccccc21- InChIKey
RFDPVHCUOLBALB-UHFFFAOYSA-N- Molecular formula
- C15H11FO2
- Average molar mass
- 242.24 g/mol
- Monoisotopic mass
- 242.07430775
Names & identifiers
- Preferred name
- 4'-(Fluoro)flavanone
- IUPAC
- 2-(4-fluorophenyl)-2,3-dihydrochromen-4-one
Names & synonyms
2-(4-fluorophenyl)chroman-4-one1840-02-44'-(Fluoro)flavanoneCHEMBL60720(+/-)-2-(4-fluorophenyl)chroman-4-one2-(4-fluorophenyl)-3,4-dihydro-2H-1-benzopyran-4-one4h-1-benzopyran-4-one,2-(4-fluorophenyl)-2,3-dihydro-SCHEMBL24745482-(4-Fluorophenyl)-2,3-dihydro-4H-1-benzopyran-4-oneDTXSID90452670RFDPVHCUOLBALB-UHFFFAOYSA-NBDBM50310197
Database identifiers
- CAS
1840-02-4- PubChem CID
- 11032058
- DTXSID
DTXSID90452670- ChEMBL
CHEMBL60720- Nikkaji
- J654.109G
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 310
Related reactions
1 records
Compound notes
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