Basic information
- Standard SMILES
N#Cc1ncccc1COc1cccc(F)c1- InChIKey
GGFYQQXAJRDCPH-UHFFFAOYSA-N- Molecular formula
- C13H9FN2O
- Average molar mass
- 228.22 g/mol
- Monoisotopic mass
- 228.06989108
Names & identifiers
- Preferred name
- 2-Cyano-3-(3-fluorophenoxymethyl)pyridine
- IUPAC
- 3-[(3-fluorophenoxy)methyl]pyridine-2-carbonitrile
Names & synonyms
SCHEMBL8802961GGFYQQXAJRDCPH-UHFFFAOYSA-NAKOS0122158152-Cyano-3-(3-fluorophenoxymethyl)pyridine
Database identifiers
- PubChem CID
- 10263162
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 45.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 288
Related reactions
2 records
Compound notes
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