tFEtO5cHtFB
Basic information
- Standard SMILES
CCCCCC1CCC(c2ccc(-c3ccc(OCC(F)(F)F)c(F)c3F)cc2F)CC1- InChIKey
PGAIOMRKEBRMJU-UHFFFAOYSA-N- Molecular formula
- C25H28F6O
- Average molar mass
- 458.5 g/mol
- Monoisotopic mass
- 458.20443448
Names & identifiers
- Preferred name
- tFEtO5cHtFB
- IUPAC
- 2,3-difluoro-1-[3-fluoro-4-(4-pentylcyclohexyl)phenyl]-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
tFEtO5cHtFBDTXSID3013799522,3,3'-trifluoro-4'-(4-pentylcyclohexyl)-4-(2,2,2-trifluoroethoxy)-1,1'-biphenyl2,3,3'-trifluoro-4'-(4-pentylcyclohexyl)-4-(2,2,2-trifluoroethoxy)biphenyl
Database identifiers
- PubChem CID
- 175685661
- DTXSID
DTXSID301379952
Properties
Computed structural properties
- XLogP
- 9.9
- 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
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Related reactions
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Compound notes
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