4-Bromo-2-fluoro-4'-cyanobiphenyl
Basic information
- Standard SMILES
N#Cc1ccc(-c2ccc(Br)cc2F)cc1- InChIKey
XEOZVFHWFFKEIY-UHFFFAOYSA-N- Molecular formula
- C13H7BrFN
- Average molar mass
- 276.1 g/mol
- Monoisotopic mass
- 274.97459
Names & identifiers
- Preferred name
- 4-Bromo-2-fluoro-4'-cyanobiphenyl
- IUPAC
- 4-(4-bromo-2-fluorophenyl)benzonitrile
Names & synonyms
SCHEMBL7719106XEOZVFHWFFKEIY-UHFFFAOYSA-N4-bromo-2-fluoro-4'-cyanobiphenyl
Database identifiers
- PubChem CID
- 12040611
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
Related reactions
1 records
Compound notes
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