Basic information
- Standard SMILES
COCC(O)(CC=O)c1ccccc1- InChIKey
GGEYEDPUEOAUTP-UHFFFAOYSA-N- Molecular formula
- C11H14O3
- Average molar mass
- 194.23 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxy-4-methoxy-3-phenyl-butyraldehyde
- IUPAC
- 3-hydroxy-4-methoxy-3-phenylbutanal
Names & synonyms
SCHEMBL117719GGEYEDPUEOAUTP-UHFFFAOYSA-N3-Hydroxy-4-methoxy-3-phenyl-butyraldehydebeta-Hydroxy-4-methoxy-3-phenyl-butyraldehyde
Database identifiers
- PubChem CID
- 59635677
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Related reactions
24 records
Compound notes
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