ChemSpider 2D Image | 3,4,5-Trifluoro-4'-(cis-4-propylcyclohexyl)biphenyl | C21H23F3

3,4,5-Trifluoro-4'-(cis-4-propylcyclohexyl)biphenyl

  • Molecular FormulaC21H23F3
  • Average mass332.402 Da
  • Monoisotopic mass332.175171 Da
  • ChemSpider ID113607814

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

3,4,5-Trifluor-4'-(cis-4-propylcyclohexyl)biphenyl [German] [ACD/IUPAC Name]
3,4,5-Trifluoro-4'-(cis-4-propylcyclohexyl)biphenyl [ACD/IUPAC Name]
3,4,5-Trifluoro-4'-(cis-4-propylcyclohexyl)biphényle [French] [ACD/IUPAC Name]
Cyclohexane, 1-propyl-4-(3',4',5'-trifluoro[1,1'-biphenyl]-4-yl)-, cis- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 402.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 228.4±18.5 °C
Index of Refraction: 1.511
Molar Refractivity: 90.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.89
ACD/LogD (pH 5.5): 7.00
ACD/BCF (pH 5.5): 122581.56
ACD/KOC (pH 5.5): 152711.84
ACD/LogD (pH 7.4): 7.00
ACD/BCF (pH 7.4): 122581.56
ACD/KOC (pH 7.4): 152711.84
Polar Surface Area: 0 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 302.6±3.0 cm3

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