Basic information
- CAS
748799-10-2- Standard SMILES
O=C1C(=Cc2ccc(O)c(F)c2)CCCC1=Cc1ccc(O)c(F)c1- InChIKey
BIBCJRNVCKNZOU-UHFFFAOYSA-N- Molecular formula
- C20H16F2O3
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.10675069
Names & identifiers
- Preferred name
- Cyclohexanone, 2,6-bis[(3-fluoro-4-hydroxyphenyl)methylene]-
- IUPAC
- 2,6-bis[(3-fluoro-4-hydroxyphenyl)methylidene]cyclohexan-1-one
Names & synonyms
748799-10-22,6-bis[(3-fluoro-4-hydroxyphenyl)methylidene]cyclohexan-1-oneCyclohexanone, 2,6-bis[(3-fluoro-4-hydroxyphenyl)methylene]-2,6-Bis(3-fluoro-4-hydroxybenzylidene)cyclohexanoneDTXSID00333269
Database identifiers
- CAS
748799-10-2- PubChem CID
- 496901
- DTXSID
DTXSID00333269
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 511
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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