ChemSpider 2D Image | 1-(6-Methyl-4-nitro-6H-pyrazolo[4,3-d][1,2]oxazol-3-yl)methanamine | C6H7N5O3

1-(6-Methyl-4-nitro-6H-pyrazolo[4,3-d][1,2]oxazol-3-yl)methanamine

  • Molecular FormulaC6H7N5O3
  • Average mass197.152 Da
  • Monoisotopic mass197.054886 Da
  • ChemSpider ID37511475

More details:

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

1-(6-Methyl-4-nitro-6H-pyrazolo[4,3-d][1,2]oxazol-3-yl)methanamin [German] [ACD/IUPAC Name]
1-(6-Methyl-4-nitro-6H-pyrazolo[4,3-d][1,2]oxazol-3-yl)methanamine [ACD/IUPAC Name]
1-(6-Méthyl-4-nitro-6H-pyrazolo[4,3-d][1,2]oxazol-3-yl)méthanamine [French] [ACD/IUPAC Name]
6H-Pyrazolo[4,3-d]isoxazole-3-methanamine, 6-methyl-4-nitro- [ACD/Index Name]
1522839-40-2 [RN]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 414.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.8±3.0 kJ/mol
Flash Point: 204.7±27.3 °C
Index of Refraction: 1.829
Molar Refractivity: 43.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.12
ACD/LogD (pH 5.5): -1.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.61
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.25
Polar Surface Area: 116 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 97.0±7.0 dyne/cm
Molar Volume: 100.2±7.0 cm3

Click to predict properties on the Chemicalize site


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