Basic information
- Standard SMILES
O=C(CCCF)c1cccc(Br)c1- InChIKey
YRRXSEQGBUCZLH-UHFFFAOYSA-N- Molecular formula
- C10H10BrFO
- Average molar mass
- 245.09 g/mol
Names & identifiers
- Preferred name
- 1-(3-Bromophenyl)-4-fluorobutan-1-one
- IUPAC
- 1-(3-bromophenyl)-4-fluorobutan-1-one
Names & synonyms
SCHEMBL3455824YRRXSEQGBUCZLH-UHFFFAOYSA-N1-(3-bromophenyl)-4-fluorobutan-1-one1-(3-bromo-phenyl)-4-fluorobutan-1-one
Database identifiers
- PubChem CID
- 57435877
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 172
Related reactions
4 records
Compound notes
Loading…