3-(3-Chlorophenyl)-2-(4-fluorophenyl)acrylonitrile
Basic information
- CAS
366-00-7- Standard SMILES
N#C/C(=C/c1cccc(Cl)c1)c1ccc(F)cc1- InChIKey
YGTSRLLKIHYZKU-JYRVWZFOSA-N- Molecular formula
- C15H9ClFN
- Average molar mass
- 257.69 g/mol
- Monoisotopic mass
- 257.0407551
Names & identifiers
- Preferred name
- 3-(3-Chlorophenyl)-2-(4-fluorophenyl)acrylonitrile
- IUPAC
- (E)-3-(3-chlorophenyl)-2-(4-fluorophenyl)prop-2-enenitrile
Names & synonyms
AKOS0023449323-(3-CHLOROPHENYL)-2-(4-FLUOROPHENYL)ACRYLONITRILE
Database identifiers
- CAS
366-00-7- PubChem CID
- 853944
- EC Number
- 123-068-4
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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