Basic information
- Standard SMILES
CCC(OC)Oc1cc(CC(C=O)C(C)C)ccc1OC- InChIKey
MSOGUARVPZWFHR-UHFFFAOYSA-N- Molecular formula
- C17H26O4
- Average molar mass
- 294.4 g/mol
Names & identifiers
- Preferred name
- 2-[[4-Methoxy-3-(1-methoxypropoxy)phenyl]methyl]-3-methylbutanal
- IUPAC
- 2-[[4-methoxy-3-(1-methoxypropoxy)phenyl]methyl]-3-methylbutanal
Names & synonyms
SCHEMBL218706
Database identifiers
- PubChem CID
- 86644012
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 293
Related reactions
1 records
Compound notes
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