Basic information
- Standard SMILES
N#Cc1ccc(COCc2cccc(F)c2)cc1- InChIKey
FGEFVILEQXBLBR-UHFFFAOYSA-N- Molecular formula
- C15H12FNO
- Average molar mass
- 241.26 g/mol
Names & identifiers
- Preferred name
- 4-((3-Fluorobenzyloxy)methyl)benzonitrile
- IUPAC
- 4-[(3-fluorophenyl)methoxymethyl]benzonitrile
Names & synonyms
SCHEMBL993572FGEFVILEQXBLBR-UHFFFAOYSA-N4-((3-fluorobenzyloxy)methyl)benzonitrile4-(((3-fluoro)benzyloxy)methyl)benzonitrile
Database identifiers
- PubChem CID
- 46223589
Properties
Computed structural properties
- XLogP
- 3.2
- 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
4 records
Compound notes
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