ChemSpider 2D Image | Amino(~2~H_2_)acetonitrile | C2H2D2N2

Amino(2H2)acetonitrile

  • Molecular FormulaC2H2D2N2
  • Average mass58.079 Da
  • Monoisotopic mass58.050003 Da
  • ChemSpider ID107437769

  • Non-standard isotope - Non-standard isotope

More details:

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

Acetonitrile-2,2-d2, 2-amino- [ACD/Index Name]
Amino(2H2)acetonitril [German] [ACD/IUPAC Name]
Amino(2H2)acetonitrile [ACD/IUPAC Name]
Amino(2H2)acétonitrile [French] [ACD/IUPAC Name]
1222011-50-8 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 164.2±23.0 °C at 760 mmHg
Vapour Pressure: 2.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.1±3.0 kJ/mol
Flash Point: 53.1±22.6 °C
Index of Refraction: 1.418
Molar Refractivity: 14.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.37
ACD/LogD (pH 5.5): -1.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.73
ACD/LogD (pH 7.4): -0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.83
Polar Surface Area: 50 Å2
Polarizability: 5.9±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 58.6±3.0 cm3

Click to predict properties on the Chemicalize site


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