4-(Trans-4-ethylcyclohexyl)-4'-(trifluoromethoxy)-1,1'-biphenyl
Basic information
- CAS
650634-92-7- Standard SMILES
CCC1CCC(c2ccc(-c3ccc(OC(F)(F)F)cc3)cc2)CC1- InChIKey
UKPTVLGWOKOZRG-UHFFFAOYSA-N- Molecular formula
- C21H23F3O
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.17009984
Names & identifiers
- Preferred name
- 4-(Trans-4-ethylcyclohexyl)-4'-(trifluoromethoxy)-1,1'-biphenyl
- IUPAC
- 1-(4-ethylcyclohexyl)-4-[4-(trifluoromethoxy)phenyl]benzene
- English name
- 1,1'-Biphenyl, 4-(trans-4-ethylcyclohexyl)-4'-(trifluoromethoxy)-
- Molecular formula
- C21H23F3O
- Molecular weight
- 348.4
Names & synonyms
650634-92-74-(Trans-4-ethylcyclohexyl)-4'-(trifluoromethoxy)-1,1'-biphenyl1-(4-ethylcyclohexyl)-4-[4-(trifluoromethoxy)phenyl]benzeneMFCD30547457tFMeO-2cHBSCHEMBL9061313SCHEMBL9061318DTXSID80598814UKPTVLGWOKOZRG-UHFFFAOYSA-NUKPTVLGWOKOZRG-WKILWMFISA-N1,1'-Biphenyl, 4-(trans-4-ethylcyclohexyl)-4'-(trifluoromethoxy)-AKOS030535695
Show more names
4-(4-Ethylcyclohexyl)-4'-(trifluoromethoxy)-1,1'-biphenyl
F214534-(4-ethylcyclohexyl)-4'-(trifluoromethoxy)biphenyl1~4~-Ethyl-3~4~-(trifluoromethoxy)-1~1~,1~2~,1~3~,1~4~,1~5~,1~6~-hexahydro-1~1~,2~1~:2~4~,3~1~-terphenyl
Database identifiers
- CAS
650634-92-7- PubChem CID
- 19436588
- DTXSID
DTXSID80598814
Properties
Computed structural properties
- XLogP
- 8.1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 384
Experimental & physicochemical properties
Chemical Classes
Fluorinated Liquid Crystal Monomers (LCM)
Liquid Crystal (LCM) Monomers
Physicochemical properties
- Boiling point
- 395.7 · 395.7±42.0 °C(Predicted)
- Density
- 1.109 · 1.109±0.06 g/cm3(Predicted)
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Related reactions
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Compound notes
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