3-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-2-methylinden-1-one
Basic information
- Standard SMILES
COc1ccc(C2=C(C)C(=O)c3c2ccc(OC)c3OC)cc1OC- InChIKey
CZKPWIYYIUZPKY-UHFFFAOYSA-N- Molecular formula
- C20H20O5
- Average molar mass
- 340.4 g/mol
- Monoisotopic mass
- 340.13107373
Names & identifiers
- Preferred name
- 3-(3,4-Dimethoxyphenyl)-6,7-dimethoxy-2-methylinden-1-one
- IUPAC
- 3-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-methylinden-1-one
Names & synonyms
NSC402777NSC-402777
Database identifiers
- PubChem CID
- 345274
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 528
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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