3-(4'-Ethoxy-2,2',3,3'-tetrafluorobiphenyl-4-yl)-6-(4-propylcyclohexyl)tetrahydropyran-2-ol
Basic information
- Standard SMILES
CCCC1CCC(C2CCC(c3ccc(-c4ccc(OCC)c(F)c4F)c(F)c3F)C(O)O2)CC1- InChIKey
HTIUXVNAVCCCIV-UHFFFAOYSA-N- Molecular formula
- C28H34F4O3
- Average molar mass
- 494.6 g/mol
Names & identifiers
- Preferred name
- 3-(4'-Ethoxy-2,2',3,3'-tetrafluorobiphenyl-4-yl)-6-(4-propylcyclohexyl)tetrahydropyran-2-ol
- IUPAC
- 3-[4-(4-ethoxy-2,3-difluorophenyl)-2,3-difluorophenyl]-6-(4-propylcyclohexyl)oxan-2-ol
Names & synonyms
SCHEMBL9898765HTIUXVNAVCCCIV-UHFFFAOYSA-N3-(4'-ethoxy-2,2',3,3'-tetrafluorobiphenyl-4-yl)-6-(4-propylcyclohexyl)tetrahydropyran-2-ol
Database identifiers
- PubChem CID
- 58535652
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 646
Related reactions
4 records
Compound notes
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