ChemSpider 2D Image | 5-Nitro-4,5-dihydro-3H-1,2,4-triazol-3-one | C2H2N4O3

5-Nitro-4,5-dihydro-3H-1,2,4-triazol-3-one

  • Molecular FormulaC2H2N4O3
  • Average mass130.062 Da
  • Monoisotopic mass130.012695 Da
  • ChemSpider ID32974159

More details:

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

3H-1,2,4-Triazol-3-one, 4,5-dihydro-5-nitro- [ACD/Index Name]
5-Nitro-4,5-dihydro-3H-1,2,4-triazol-3-on [German] [ACD/IUPAC Name]
5-Nitro-4,5-dihydro-3H-1,2,4-triazol-3-one [ACD/IUPAC Name]
5-Nitro-4,5-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]

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

Density: 2.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.918
Molar Refractivity: 24.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.67
ACD/LogD (pH 5.5): -3.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 100 Å2
Polarizability: 9.9±0.5 10-24cm3
Surface Tension: 158.4±7.0 dyne/cm
Molar Volume: 52.8±7.0 cm3

Click to predict properties on the Chemicalize site


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