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Basic information
- Standard SMILES
COc1cc(C=C2CCCC(=Cc3cc(OC)c(O)c(OC)c3)C2=O)cc(OC)c1O- InChIKey
QMHMTEMGAVZCQH-UHFFFAOYSA-N- Molecular formula
- C24H26O7
- Average molar mass
- 426.5 g/mol
- Monoisotopic mass
- 426.16785316
Names & identifiers
- Preferred name
- 2,6-Bis[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]cyclohexan-1-one
- IUPAC
- 2,6-bis[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]cyclohexan-1-one
Names & synonyms
SCHEMBL6851637NCI60_037652
Database identifiers
- PubChem CID
- 397491
Properties
Computed structural propertiesFilling in
- XLogP
- 4.2
- Topological polar surface area
- 94.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 591
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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