ChemSpider 2D Image | 1,1,1-Trifluoro-3-{[3-(4-fluoro-3-methylphenoxy)phenyl][3-(trifluoromethoxy)benzyl]amino}-2-propanol | C24H20F7NO3

1,1,1-Trifluoro-3-{[3-(4-fluoro-3-methylphenoxy)phenyl][3-(trifluoromethoxy)benzyl]amino}-2-propanol

  • Molecular FormulaC24H20F7NO3
  • Average mass503.409 Da
  • Monoisotopic mass503.133148 Da
  • ChemSpider ID8089660

More details:

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

1,1,1-Trifluor-3-{[3-(4-fluor-3-methylphenoxy)phenyl][3-(trifluormethoxy)benzyl]amino}-2-propanol [German] [ACD/IUPAC Name]
1,1,1-Trifluoro-3-{[3-(4-fluoro-3-methylphenoxy)phenyl][3-(trifluoromethoxy)benzyl]amino}-2-propanol [ACD/IUPAC Name]
1,1,1-Trifluoro-3-{[3-(4-fluoro-3-méthylphénoxy)phényl][3-(trifluorométhoxy)benzyl]amino}-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1,1,1-trifluoro-3-[[3-(4-fluoro-3-methylphenoxy)phenyl][[3-(trifluoromethoxy)phenyl]methyl]amino]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 527.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.5±3.0 kJ/mol
Flash Point: 273.0±30.1 °C
Index of Refraction: 1.538
Molar Refractivity: 114.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.99
ACD/LogD (pH 5.5): 6.72
ACD/BCF (pH 5.5): 75650.59
ACD/KOC (pH 5.5): 108097.79
ACD/LogD (pH 7.4): 6.72
ACD/BCF (pH 7.4): 75658.06
ACD/KOC (pH 7.4): 108108.47
Polar Surface Area: 42 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 38.7±3.0 dyne/cm
Molar Volume: 366.9±3.0 cm3

Click to predict properties on the Chemicalize site


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