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

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

  • Molecular FormulaC2H2N4O3
  • Average mass130.062 Da
  • Monoisotopic mass130.012695 Da
  • ChemSpider ID32990049

More details:






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

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

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

Density: 2.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.827
Molar Refractivity: 25.8±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.50
ACD/LogD (pH 5.5): -1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.14
ACD/LogD (pH 7.4): -1.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.75
Polar Surface Area: 91 Å2
Polarizability: 10.2±0.5 10-24cm3
Surface Tension: 137.6±7.0 dyne/cm
Molar Volume: 58.8±7.0 cm3

Click to predict properties on the Chemicalize site






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