ChemSpider 2D Image | 2-[Methyl(nitroso)amino]-6H-purin-6-one | C6H4N6O2

2-[Methyl(nitroso)amino]-6H-purin-6-one

  • Molecular FormulaC6H4N6O2
  • Average mass192.135 Da
  • Monoisotopic mass192.039566 Da
  • ChemSpider ID60751172

More details:

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

2-[Methyl(nitroso)amino]-6H-purin-6-on [German] [ACD/IUPAC Name]
2-[Methyl(nitroso)amino]-6H-purin-6-one [ACD/IUPAC Name]
2-[Méthyl(nitroso)amino]-6H-purin-6-one [French] [ACD/IUPAC Name]
6H-Purin-6-one, 2-(methylnitrosoamino)- [ACD/Index Name]
41286-75-3 [RN]
MFCD20692124

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

Density: 1.9±0.1 g/cm3
Boiling Point: 289.7±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.9±3.0 kJ/mol
Flash Point: 129.0±22.6 °C
Index of Refraction: 1.879
Molar Refractivity: 45.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -2.61
ACD/LogD (pH 5.5): -1.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.70
ACD/LogD (pH 7.4): -1.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.70
Polar Surface Area: 99 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 95.4±7.0 dyne/cm
Molar Volume: 100.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement