ChemSpider 2D Image | (~2~H_4_)-3-Pyridinylacetonitrile | C7H2D4N2

(2H4)-3-Pyridinylacetonitrile

  • Molecular FormulaC7H2D4N2
  • Average mass122.161 Da
  • Monoisotopic mass122.078201 Da
  • ChemSpider ID58794607

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H4)-3-Pyridinylacetonitril [German] [ACD/IUPAC Name]
(2H4)-3-Pyridinylacetonitrile [ACD/IUPAC Name]
(2H4)-3-Pyridinylacétonitrile [French] [ACD/IUPAC Name]
Pyridine-2,4,5,6-d4-3-acetonitrile [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 275.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 51.4±3.0 kJ/mol
Flash Point: 98.3±0.0 °C
Index of Refraction: 1.533
Molar Refractivity: 33.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.04
ACD/LogD (pH 5.5): 0.65
ACD/BCF (pH 5.5): 1.83
ACD/KOC (pH 5.5): 52.96
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.91
ACD/KOC (pH 7.4): 55.38
Polar Surface Area: 37 Å2
Polarizability: 13.4±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 108.9±3.0 cm3

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