Basic information
- Standard SMILES
C=CCCC1CCC(c2ccc(-c3ccc(OCC(F)(F)F)c(F)c3F)cc2)CC1- InChIKey
MVLGZHOWTMWFQR-UHFFFAOYSA-N- Molecular formula
- C24H25F5O
- Average molar mass
- 424.4 g/mol
- Monoisotopic mass
- 424.18255623
Names & identifiers
- Preferred name
- BecHtFEtOdFB
- IUPAC
- 1-[4-(4-but-3-enylcyclohexyl)phenyl]-2,3-difluoro-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
BecHtFEtOdFBDTXSID0013800834'-(4-(but-3-en-1-yl)cyclohexyl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)-1,1'-biphenyl4'-[4-(but-3-en-1-yl)cyclohexyl]-2,3-difluoro-4-(2,2,2-trifluoroethoxy)biphenyl
Database identifiers
- PubChem CID
- 175685473
- DTXSID
DTXSID001380083
Properties
Computed structural properties
- XLogP
- 8.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 520
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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