ChemSpider 2D Image | 4-{[2-(Methylsulfonyl)ethyl]sulfonyl}-2-morpholinecarbonitrile | C8H14N2O5S2

4-{[2-(Methylsulfonyl)ethyl]sulfonyl}-2-morpholinecarbonitrile

  • Molecular FormulaC8H14N2O5S2
  • Average mass282.337 Da
  • Monoisotopic mass282.034424 Da
  • ChemSpider ID49348154

More details:






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

2-Morpholinecarbonitrile, 4-[[2-(methylsulfonyl)ethyl]sulfonyl]- [ACD/Index Name]
4-{[2-(Methylsulfonyl)ethyl]sulfonyl}-2-morpholincarbonitril [German] [ACD/IUPAC Name]
4-{[2-(Methylsulfonyl)ethyl]sulfonyl}-2-morpholinecarbonitrile [ACD/IUPAC Name]
4-{[2-(Méthylsulfonyl)éthyl]sulfonyl}-2-morpholinecarbonitrile [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 584.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.4±3.0 kJ/mol
Flash Point: 307.4±32.9 °C
Index of Refraction: 1.549
Molar Refractivity: 60.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -2.04
ACD/LogD (pH 5.5): -1.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.27
ACD/LogD (pH 7.4): -1.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.27
Polar Surface Area: 121 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 189.2±5.0 cm3

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