ChemSpider 2D Image | 3-{(R)-(4-Chlorophenyl)[2-(trifluoromethyl)phenyl]methoxy}-N-(2-methyl-2-propanyl)-1-azetidinecarboxamide | C22H24ClF3N2O2

3-{(R)-(4-Chlorophenyl)[2-(trifluoromethyl)phenyl]methoxy}-N-(2-methyl-2-propanyl)-1-azetidinecarboxamide

  • Molecular FormulaC22H24ClF3N2O2
  • Average mass440.886 Da
  • Monoisotopic mass440.147827 Da
  • ChemSpider ID128922145

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Azetidinecarboxamide, 3-[(R)-(4-chlorophenyl)[2-(trifluoromethyl)phenyl]methoxy]-N-(1,1-dimethylethyl)- [ACD/Index Name]
3-{(R)-(4-Chlorophenyl)[2-(trifluoromethyl)phenyl]methoxy}-N-(2-methyl-2-propanyl)-1-azetidinecarboxamide [ACD/IUPAC Name]
3-{(R)-(4-Chlorophényl)[2-(trifluorométhyl)phényl]méthoxy}-N-(2-méthyl-2-propanyl)-1-azétidinecarboxamide [French] [ACD/IUPAC Name]
3-{(R)-(4-Chlorphenyl)[2-(trifluormethyl)phenyl]methoxy}-N-(2-methyl-2-propanyl)-1-azetidincarboxamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 537.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 278.6±30.1 °C
Index of Refraction: 1.564
Molar Refractivity: 110.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 5.80
ACD/BCF (pH 5.5): 15161.70
ACD/KOC (pH 5.5): 34211.08
ACD/LogD (pH 7.4): 5.80
ACD/BCF (pH 7.4): 15161.70
ACD/KOC (pH 7.4): 34211.08
Polar Surface Area: 42 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 45.4±5.0 dyne/cm
Molar Volume: 339.0±5.0 cm3

Click to predict properties on the Chemicalize site


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