ChemSpider 2D Image | N-(4-Fluorophenyl)-N-(2-pyridinylmethyl)-2-{[3-(trifluoromethyl)phenyl]sulfanyl}acetamide | C21H16F4N2OS

N-(4-Fluorophenyl)-N-(2-pyridinylmethyl)-2-{[3-(trifluoromethyl)phenyl]sulfanyl}acetamide

  • Molecular FormulaC21H16F4N2OS
  • Average mass420.423 Da
  • Monoisotopic mass420.091949 Da
  • ChemSpider ID76945828

More details:

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

Acetamide, N-(4-fluorophenyl)-N-(2-pyridinylmethyl)-2-[[3-(trifluoromethyl)phenyl]thio]- [ACD/Index Name]
N-(4-Fluorophenyl)-N-(2-pyridinylmethyl)-2-{[3-(trifluoromethyl)phenyl]sulfanyl}acetamide [ACD/IUPAC Name]
N-(4-Fluorophényl)-N-(2-pyridinylméthyl)-2-{[3-(trifluorométhyl)phényl]sulfanyl}acétamide [French] [ACD/IUPAC Name]
N-(4-Fluorphenyl)-N-(2-pyridinylmethyl)-2-{[3-(trifluormethyl)phenyl]sulfanyl}acetamid [German] [ACD/IUPAC 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: 512.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±3.0 kJ/mol
Flash Point: 263.6±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 105.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 4.59
ACD/BCF (pH 5.5): 1814.57
ACD/KOC (pH 5.5): 7447.07
ACD/LogD (pH 7.4): 4.60
ACD/BCF (pH 7.4): 1847.41
ACD/KOC (pH 7.4): 7581.84
Polar Surface Area: 59 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 52.4±5.0 dyne/cm
Molar Volume: 304.8±5.0 cm3

Click to predict properties on the Chemicalize site


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