Basic information
- Standard SMILES
CCCCCc1ccc(-c2ccc(-c3ccc(OCC(F)(F)F)c(F)c3F)c(F)c2)cc1- InChIKey
GEXYJOXNDDNDNT-UHFFFAOYSA-N- Molecular formula
- C25H22F6O
- Average molar mass
- 452.4 g/mol
- Monoisotopic mass
- 452.15748429
Names & identifiers
- Preferred name
- 2,2',3-Trifluoro-4''-pentyl-4-(2,2,2-trifluoroethoxy)-1,1':4',1''-terphenyl
- IUPAC
- 2,3-difluoro-1-[2-fluoro-4-(4-pentylphenyl)phenyl]-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
2,2',3-trifluoro-4''-pentyl-4-(2,2,2-trifluoroethoxy)-1,1':4',1''-terphenyl5tFEtOtFTDTXSID901380004
Database identifiers
- PubChem CID
- 175684995
- DTXSID
DTXSID901380004
Properties
Computed structural properties
- XLogP
- 9
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 547
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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