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Basic information
- Standard SMILES
CC(=O)/C=C/c1cccc(Oc2ccc(F)cc2)c1- InChIKey
RNCJHSIOCWFTLR-AATRIKPKSA-N- Molecular formula
- C16H13FO2
- Average molar mass
- 256.27 g/mol
- Monoisotopic mass
- 256.08995782
Names & identifiers
- Preferred name
- (E)-1-[3-(4-Fluorophenoxy)phenyl]buten-3-one
- IUPAC
- (E)-4-[3-(4-fluorophenoxy)phenyl]but-3-en-2-one
Names & synonyms
SCHEMBL9517950RNCJHSIOCWFTLR-AATRIKPKSA-N(E)-1-[3-(4-Fluorophenoxy)phenyl]buten-3-one
Database identifiers
- PubChem CID
- 20073371
Properties
Computed structural propertiesFilling in
- XLogP
- 3.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 319
Related reactions
1 records
Compound notes
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