ChemSpider 2D Image | 1,6-Dihydro-1,2,4,5-tetrazine | C2H4N4

1,6-Dihydro-1,2,4,5-tetrazine

  • Molecular FormulaC2H4N4
  • Average mass84.080 Da
  • Monoisotopic mass84.043594 Da
  • ChemSpider ID67171485

More details:






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

1,2,4,5-Tetrazine, 1,6-dihydro- [ACD/Index Name]
1,6-Dihydro-1,2,4,5-tetrazin [German] [ACD/IUPAC Name]
1,6-Dihydro-1,2,4,5-tetrazine [ACD/IUPAC Name]
1,6-Dihydro-1,2,4,5-tétrazine [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 106.7±23.0 °C at 760 mmHg
Vapour Pressure: 27.9±0.2 mmHg at 25°C
Enthalpy of Vaporization: 34.6±3.0 kJ/mol
Flash Point: 18.4±22.6 °C
Index of Refraction: 1.717
Molar Refractivity: 21.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.96
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 23.46
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.87
Polar Surface Area: 49 Å2
Polarizability: 8.5±0.5 10-24cm3
Surface Tension: 67.2±7.0 dyne/cm
Molar Volume: 54.4±7.0 cm3

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