ChemSpider 2D Image | 3-Amino-2-propyne-1,1,1-tricarbonitrile | C6H2N4

3-Amino-2-propyne-1,1,1-tricarbonitrile

  • Molecular FormulaC6H2N4
  • Average mass130.107 Da
  • Monoisotopic mass130.027939 Da
  • ChemSpider ID65793436

More details:

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

2-Propyne-1,1,1-tricarbonitrile, 3-amino- [ACD/Index Name]
3-Amino-2-propin-1,1,1-tricarbonitril [German] [ACD/IUPAC Name]
3-Amino-2-propyne-1,1,1-tricarbonitrile [ACD/IUPAC Name]
3-Amino-2-propyne-1,1,1-tricarbonitrile [French] [ACD/IUPAC Name]
tricyanoaminopropine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 255.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.3±3.0 kJ/mol
Flash Point: 108.1±30.1 °C
Index of Refraction: 1.570
Molar Refractivity: 31.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.26
ACD/KOC (pH 5.5): 390.07
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.26
ACD/KOC (pH 7.4): 390.07
Polar Surface Area: 97 Å2
Polarizability: 12.3±0.5 10-24cm3
Surface Tension: 97.9±3.0 dyne/cm
Molar Volume: 94.8±3.0 cm3

Click to predict properties on the Chemicalize site


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