Basic information
- Standard SMILES
CCC1CCC(C2CCC(c3ccc(OCC(F)(F)F)c(F)c3F)CC2)CC1- InChIKey
OOWPKKIKAFJGPC-UHFFFAOYSA-N- Molecular formula
- C22H29F5O
- Average molar mass
- 404.5 g/mol
- Monoisotopic mass
- 404.21385635
Names & identifiers
- Preferred name
- 2bcHtFEtOdFP
- IUPAC
- 1-[4-(4-ethylcyclohexyl)cyclohexyl]-2,3-difluoro-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
2bcHtFEtOdFPDTXSID9013798934-(2,3-difluoro-4-(2,2,2-trifluoroethoxy)phenyl)-4'-ethyl-1,1'-bi(cyclohexane)4-[2,3-difluoro-4-(2,2,2-trifluoroethoxy)phenyl]-4'-ethyl-1,1'-bi(cyclohexyl)
Database identifiers
- PubChem CID
- 175685600
- DTXSID
DTXSID901379893
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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