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Basic information
- Standard SMILES
N#C/C(=C\c1cccc(Br)c1F)c1ccc(Cl)cc1F- InChIKey
YRRAGBCXQBPSKP-UXBLZVDNSA-N- Molecular formula
- C15H7BrClF2N
- Average molar mass
- 354.57 g/mol
Names & identifiers
- Preferred name
- (Z)-3-(3-bromo-2-fluoro-phenyl)-2-(4-chloro-2-fluoro-phenyl)-acrylonitrile
- IUPAC
- (Z)-3-(3-bromo-2-fluorophenyl)-2-(4-chloro-2-fluorophenyl)prop-2-enenitrile
Names & synonyms
SCHEMBL2151238YRRAGBCXQBPSKP-UXBLZVDNSA-N(Z)-3-(3-bromo-2-fluoro-phenyl)-2-(4-chloro-2-fluoro-phenyl)-acrylonitrile
Database identifiers
- PubChem CID
- 59249486
Properties
Computed structural propertiesFilling in
- XLogP
- 5.2
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 419
Related reactions
2 records
Compound notes
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