2cHtFEtOdFB
Basic information
- Standard SMILES
CCC1CCC(c2ccc(-c3ccc(OCC(F)(F)F)c(F)c3F)cc2)CC1- InChIKey
XRDRZSIWLOZSGP-UHFFFAOYSA-N- Molecular formula
- C22H23F5O
- Average molar mass
- 398.4 g/mol
- Monoisotopic mass
- 398.16690616
Names & identifiers
- Preferred name
- 2cHtFEtOdFB
- IUPAC
- 1-[4-(4-ethylcyclohexyl)phenyl]-2,3-difluoro-4-(2,2,2-trifluoroethoxy)benzene
Names & synonyms
2cHtFEtOdFBDTXSID0013800694'-(4-ethylcyclohexyl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)biphenyl4'-(4-ethylcyclohexyl)-2,3-difluoro-4-(2,2,2-trifluoroethoxy)-1,1'-biphenyl
Database identifiers
- PubChem CID
- 175686215
- DTXSID
DTXSID001380069
Properties
Computed structural properties
- XLogP
- 8.2
- 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
Loading…