ChemSpider 2D Image | 3-[(~2~H_3_)Methyl(nitroso)amino]propanenitrile | C4H4D3N3O

3-[(2H3)Methyl(nitroso)amino]propanenitrile

  • Molecular FormulaC4H4D3N3O
  • Average mass116.136 Da
  • Monoisotopic mass116.077744 Da
  • ChemSpider ID48062027

  • Non-standard isotope - Non-standard isotope

More details:

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

3-[(2H3)Methyl(nitroso)amino]propanenitrile [ACD/IUPAC Name]
3-[(2H3)Méthyl(nitroso)amino]propanenitrile [French] [ACD/IUPAC Name]
3-[(2H3)Methyl(nitroso)amino]propannitril [German] [ACD/IUPAC Name]
Propanenitrile, 3-(methyl-d3nitrosoamino)- [ACD/Index Name]
1329834-39-0 [RN]
N-(2-cyanoethyl)-N-(trideuteriomethyl)nitrous amide

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

Density: 1.1±0.1 g/cm3
Boiling Point: 311.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.2±3.0 kJ/mol
Flash Point: 141.9±23.2 °C
Index of Refraction: 1.492
Molar Refractivity: 30.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.28
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.09
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.09
Polar Surface Area: 56 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 105.3±7.0 cm3

Click to predict properties on the Chemicalize site


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