Basic information
- Standard SMILES
CCCc1ccc(C(F)=C(F)c2ccc(C#N)c(F)c2)cc1- InChIKey
WXSUFAZJSCGRRO-UHFFFAOYSA-N- Molecular formula
- C18H14F3N
- Average molar mass
- 301.3 g/mol
- Monoisotopic mass
- 301.10783394
Names & identifiers
- Preferred name
- 3PFCPdFV
- IUPAC
- 4-[1,2-difluoro-2-(4-propylphenyl)ethenyl]-2-fluorobenzonitrile
Names & synonyms
3PFCPdFVDTXSID9013819214-(1,2-difluoro-2-(4-propylphenyl)vinyl)-2-fluorobenzonitrile4-[1,2-difluoro-2-(4-propylphenyl)ethenyl]-2-fluorobenzonitrile
Database identifiers
- PubChem CID
- 175686144
- DTXSID
DTXSID901381921
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 442
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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