ChemSpider 2D Image | 4-(trans-4-Ethylcyclohexyl)-4'-(trifluoromethyl)biphenyl | C21H23F3

4-(trans-4-Ethylcyclohexyl)-4'-(trifluoromethyl)biphenyl

  • Molecular FormulaC21H23F3
  • Average mass332.402 Da
  • Monoisotopic mass332.175171 Da
  • ChemSpider ID29366038

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1072141-52-6 [RN]
4-(trans-4-Ethylcyclohexyl)-4'-(trifluormethyl)biphenyl [German] [ACD/IUPAC Name]
4-(trans-4-Ethylcyclohexyl)-4'-(trifluoromethyl)biphenyl [ACD/IUPAC Name]
4-(trans-4-Éthylcyclohexyl)-4'-(trifluorométhyl)biphényle [French] [ACD/IUPAC Name]
4-[(1s,4r)-4-ethylcyclohexyl]-4'-(trifluoromethyl)-1,1'-biphenyl
Cyclohexane, 1-ethyl-4-[4'-(trifluoromethyl)[1,1'-biphenyl]-4-yl]-, trans- [ACD/Index Name]
4-(trans-4-ethylcyclohexyl)-4'-(trifluoroMethyl)-1,1'-Biphenyl
4-(trans-4-Ethylcyclohexyl)-4'(trifluoromethyl)-1,1'-biphenyl

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 389.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 61.4±3.0 kJ/mol
Flash Point: 159.5±15.8 °C
Index of Refraction: 1.505
Molar Refractivity: 91.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.49
ACD/LogD (pH 5.5): 7.70
ACD/BCF (pH 5.5): 422556.25
ACD/KOC (pH 5.5): 370322.94
ACD/LogD (pH 7.4): 7.70
ACD/BCF (pH 7.4): 422556.25
ACD/KOC (pH 7.4): 370322.94
Polar Surface Area: 0 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 31.7±3.0 dyne/cm
Molar Volume: 307.0±3.0 cm3

Click to predict properties on the Chemicalize site


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