Basic information
- Standard SMILES
N#Cc1cnc(OCc2ccccc2)c(O)c1- InChIKey
CKMHANCDNMHXRJ-UHFFFAOYSA-N- Molecular formula
- C13H10N2O2
- Average molar mass
- 226.23 g/mol
Names & identifiers
- Preferred name
- 6-Benzyloxy-5-hydroxynicotinonitrile
- IUPAC
- 5-hydroxy-6-phenylmethoxypyridine-3-carbonitrile
Names & synonyms
SCHEMBL7990621CKMHANCDNMHXRJ-UHFFFAOYSA-N6-benzyloxy-5-hydroxynicotinonitrile
Database identifiers
- PubChem CID
- 21702680
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 280
Related reactions
1 records
Compound notes
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