Basic information
- Standard SMILES
CC(=O)OCCCCCOc1cccc(C=O)c1- InChIKey
QUBXEQYKQAQUDL-UHFFFAOYSA-N- Molecular formula
- C14H18O4
- Average molar mass
- 250.29 g/mol
Names & identifiers
- Preferred name
- 3-[[5-(Acetyloxy)pentyl]oxy]benzaldehyde
- IUPAC
- 5-(3-formylphenoxy)pentyl acetate
Names & synonyms
SCHEMBL9121016QUBXEQYKQAQUDL-UHFFFAOYSA-N3-[[5-(acetyloxy)pentyl]oxy]benzaldehyde
Database identifiers
- PubChem CID
- 19922110
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 252
Related reactions
5 records
Compound notes
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