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

2-Nitroso-1,2-dihydro-3H-1,2,4-triazol-3-one 1-oxide

  • Molecular FormulaC2H2N4O3
  • Average mass130.062 Da
  • Monoisotopic mass130.012695 Da
  • ChemSpider ID67498591

More details:






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

1-Oxyde de 2-nitroso-1,2-dihydro-3H-1,2,4-triazol-3-one [French] [ACD/IUPAC Name]
2-Nitroso-1,2-dihydro-3H-1,2,4-triazol-3-on-1-oxid [German] [ACD/IUPAC Name]
2-Nitroso-1,2-dihydro-3H-1,2,4-triazol-3-one 1-oxide [ACD/IUPAC Name]
3H-1,2,4-Triazol-3-one, 1,2-dihydro-2-nitroso-, 1-oxide [ACD/Index Name]
1-nitroso-1,2,4-triazol-5-one-2-oxide

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

Density: 2.2±0.1 g/cm3
Boiling Point: 237.5±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 55.1±6.0 kJ/mol
Flash Point: 97.4±22.6 °C
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: -1.81
ACD/LogD (pH 5.5): -3.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 79 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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