Basic information
- Standard SMILES
N#Cc1ccc(OCCc2cccc(F)c2)cc1- InChIKey
ZMKSKJVXMZHVPA-UHFFFAOYSA-N- Molecular formula
- C15H12FNO
- Average molar mass
- 241.26 g/mol
- Monoisotopic mass
- 241.09029217
Names & identifiers
- Preferred name
- 4-((3'-Fluoro)phenethoxy)benzonitrile
- IUPAC
- 4-[2-(3-fluorophenyl)ethoxy]benzonitrile
Names & synonyms
SCHEMBL992663ZMKSKJVXMZHVPA-UHFFFAOYSA-N4-((3'-fluoro)phenethoxy)benzonitrile
Database identifiers
- PubChem CID
- 46223591
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 33 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 290
Related reactions
2 records
Compound notes
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