ChemSpider 2D Image | 4,5-Dinitro-2H-1,2,3-triazol-2-amine | C2H2N6O4

4,5-Dinitro-2H-1,2,3-triazol-2-amine

  • Molecular FormulaC2H2N6O4
  • Average mass174.075 Da
  • Monoisotopic mass174.013748 Da
  • ChemSpider ID29371964

More details:

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

2H-1,2,3-Triazol-2-amine, 4,5-dinitro- [ACD/Index Name]
4,5-Dinitro-2H-1,2,3-triazol-2-amin [German] [ACD/IUPAC Name]
4,5-Dinitro-2H-1,2,3-triazol-2-amine [ACD/IUPAC Name]
4,5-Dinitro-2H-1,2,3-triazol-2-amine [French] [ACD/IUPAC Name]
2-Amino-4,5-dinitro-1,2,3-2H-triazole

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

Density: 2.7±0.1 g/cm3
Boiling Point: 535.6±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.7±30.9 °C
Index of Refraction: 2.025
Molar Refractivity: 32.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.28
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.69
ACD/LogD (pH 7.4): -0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.69
Polar Surface Area: 148 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 228.0±7.0 dyne/cm
Molar Volume: 64.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement