ChemSpider 2D Image | 5-Nitro-1H-pyrazolo[3,4-b]pyridin-3-amine | C6H5N5O2

5-Nitro-1H-pyrazolo[3,4-b]pyridin-3-amine

  • Molecular FormulaC6H5N5O2
  • Average mass179.136 Da
  • Monoisotopic mass179.044327 Da
  • ChemSpider ID29773970

More details:

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

1H-Pyrazolo[3,4-b]pyridin-3-amine, 5-nitro- [ACD/Index Name]
5-Nitro-1H-pyrazolo[3,4-b]pyridin-3-amin [German] [ACD/IUPAC Name]
5-Nitro-1H-pyrazolo[3,4-b]pyridin-3-amine [ACD/IUPAC Name]
5-Nitro-1H-pyrazolo[3,4-b]pyridin-3-amine [French] [ACD/IUPAC Name]
1186608-97-8 [RN]
3-Amino-5-nitro-1H-pyrazolo[3,4-b]pyridine
MFCD19690165

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

Density: 1.7±0.1 g/cm3
Boiling Point: 490.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 250.7±27.3 °C
Index of Refraction: 1.843
Molar Refractivity: 45.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.32
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.61
ACD/KOC (pH 5.5): 48.82
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.50
ACD/KOC (pH 7.4): 45.46
Polar Surface Area: 113 Å2
Polarizability: 18.0±0.5 10-24cm3
Surface Tension: 121.8±3.0 dyne/cm
Molar Volume: 102.4±3.0 cm3

Click to predict properties on the Chemicalize site


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