ChemSpider 2D Image | 2,3-Diiminopropanenitrile | C3H3N3

2,3-Diiminopropanenitrile

  • Molecular FormulaC3H3N3
  • Average mass81.076 Da
  • Monoisotopic mass81.032700 Da
  • ChemSpider ID65793198

More details:

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

2,3-Diiminopropanenitrile [ACD/IUPAC Name]
2,3-Diiminopropanenitrile [French] [ACD/IUPAC Name]
2,3-Diiminopropannitril [German] [ACD/IUPAC Name]
Propanenitrile, 2,3-diimino- [ACD/Index Name]
diiminopropionitrile

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

Density: 1.1±0.1 g/cm3
Boiling Point: 84.9±23.0 °C at 760 mmHg
Vapour Pressure: 70.8±0.2 mmHg at 25°C
Enthalpy of Vaporization: 32.5±3.0 kJ/mol
Flash Point: 5.2±22.6 °C
Index of Refraction: 1.539
Molar Refractivity: 22.1±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.43
ACD/LogD (pH 5.5): -0.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.48
ACD/LogD (pH 7.4): -0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.49
Polar Surface Area: 71 Å2
Polarizability: 8.8±0.5 10-24cm3
Surface Tension: 54.5±7.0 dyne/cm
Molar Volume: 70.5±7.0 cm3

Click to predict properties on the Chemicalize site


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