Basic information
- Standard SMILES
Cc1ccc(OCc2ccc(C=O)cc2)nc1- InChIKey
IXAUCMLTNYQQDS-UHFFFAOYSA-N- Molecular formula
- C14H13NO2
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.09462866
Names & identifiers
- Preferred name
- 4-(5-Methyl-pyridin-2-yloxymethyl)-benzaldehyde
- IUPAC
- 4-[(5-methyl-2-pyridinyl)oxymethyl]benzaldehyde
Names & synonyms
SCHEMBL509595IXAUCMLTNYQQDS-UHFFFAOYSA-N4-(5-Methyl-pyridin-2-yloxymethyl)-benzaldehyde
Database identifiers
- PubChem CID
- 59255142
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 236
Related reactions
12 records
Compound notes
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