ChemSpider 2D Image | N-(2-Piperidinylmethyl)-2,5-bis{[2,2,2-trifluoro(~2~H_2_)ethyl]oxy}benzamide | C17H16D4F6N2O3

N-(2-Piperidinylmethyl)-2,5-bis{[2,2,2-trifluoro(2H2)ethyl]oxy}benzamide

  • Molecular FormulaC17H16D4F6N2O3
  • Average mass418.367 Da
  • Monoisotopic mass418.162933 Da
  • ChemSpider ID48062910

  • Non-standard isotope - Non-standard isotope

More details:

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

Benzamide, N-(2-piperidinylmethyl)-2,5-bis[(2,2,2-trifluoroethyl-1,1-d2)oxy]- [ACD/Index Name]
N-(2-Piperidinylmethyl)-2,5-bis{[2,2,2-trifluor(2H2)ethyl]oxy}benzamid [German] [ACD/IUPAC Name]
N-(2-Piperidinylmethyl)-2,5-bis{[2,2,2-trifluoro(2H2)ethyl]oxy}benzamide [ACD/IUPAC Name]
N-(2-Pipéridinylméthyl)-2,5-bis{[2,2,2-trifluoro(2H2)éthyl]oxy}benzamide [French] [ACD/IUPAC Name]
1276197-20-6 [RN]
2,5-bis(1,1-dideuterio-2,2,2-trifluoroethoxy)-N-(piperidin-2-ylmethyl)benzamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 434.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.8±28.7 °C
Index of Refraction: 1.458
Molar Refractivity: 87.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.90
ACD/LogD (pH 5.5): 0.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.07
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 1.05
ACD/KOC (pH 7.4): 8.93
Polar Surface Area: 60 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 32.0±3.0 dyne/cm
Molar Volume: 322.1±3.0 cm3

Click to predict properties on the Chemicalize site


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