ChemSpider 2D Image | 1-(3,5-Dimethylphenoxy)-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]cyclohexanecarboxamide | C27H33F3N2O2

1-(3,5-Dimethylphenoxy)-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]cyclohexanecarboxamide

  • Molecular FormulaC27H33F3N2O2
  • Average mass474.558 Da
  • Monoisotopic mass474.249420 Da
  • ChemSpider ID67734677

More details:

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

1-(3,5-Dimethylphenoxy)-N-[2-(1-piperidinyl)-5-(trifluormethyl)phenyl]cyclohexancarboxamid [German] [ACD/IUPAC Name]
1-(3,5-Dimethylphenoxy)-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]cyclohexanecarboxamide [ACD/IUPAC Name]
1-(3,5-Diméthylphénoxy)-N-[2-(1-pipéridinyl)-5-(trifluorométhyl)phényl]cyclohexanecarboxamide [French] [ACD/IUPAC Name]
Cyclohexanecarboxamide, 1-(3,5-dimethylphenoxy)-N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 608.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.4±3.0 kJ/mol
Flash Point: 322.0±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 127.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.91
ACD/LogD (pH 5.5): 6.83
ACD/BCF (pH 5.5): 90614.70
ACD/KOC (pH 5.5): 122124.68
ACD/LogD (pH 7.4): 6.84
ACD/BCF (pH 7.4): 92918.45
ACD/KOC (pH 7.4): 125229.54
Polar Surface Area: 42 Å2
Polarizability: 50.4±0.5 10-24cm3
Surface Tension: 44.8±3.0 dyne/cm
Molar Volume: 391.3±3.0 cm3

Click to predict properties on the Chemicalize site


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