ChemSpider 2D Image | 1-(4-Aminophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one | C11H9N5O

1-(4-Aminophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one

  • Molecular FormulaC11H9N5O
  • Average mass227.222 Da
  • Monoisotopic mass227.080704 Da
  • ChemSpider ID21926858

More details:

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

1-(4-Aminophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-on [German] [ACD/IUPAC Name]
1-(4-Aminophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [ACD/IUPAC Name]
1-(4-Aminophényl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one [French] [ACD/IUPAC Name]
4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1-(4-aminophenyl)-1,5-dihydro- [ACD/Index Name]
1-(4-aminophenyl)-1H,4H,5H-pyrazolo[3,4-d]pyrimidin-4-one
1050884-19-9 [RN]
MFCD09971603 [MDL number]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 547.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 284.9±24.6 °C
Index of Refraction: 1.805
Molar Refractivity: 61.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.62
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 27.33
ACD/LogD (pH 7.4): 0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.58
Polar Surface Area: 85 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 74.7±7.0 dyne/cm
Molar Volume: 143.2±7.0 cm3

Click to predict properties on the Chemicalize site


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