ChemSpider 2D Image | 4-(2-Fluorophenyl)-N~6~-(2-methoxyethyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine | C15H17FN6O

4-(2-Fluorophenyl)-N6-(2-methoxyethyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine

  • Molecular FormulaC15H17FN6O
  • Average mass316.333 Da
  • Monoisotopic mass316.144775 Da
  • ChemSpider ID22619057

More details:

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

2H-Pyrazolo[3,4-d]pyrimidine-3,6-diamine, 4-(2-fluorophenyl)-N6-(2-methoxyethyl)-2-methyl- [ACD/Index Name]
4-(2-Fluorophenyl)-N6-(2-methoxyethyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine [ACD/IUPAC Name]
4-(2-Fluorophényl)-N6-(2-méthoxyéthyl)-2-méthyl-2H-pyrazolo[3,4-d]pyrimidine-3,6-diamine [French] [ACD/IUPAC Name]
4-(2-Fluorphenyl)-N6-(2-methoxyethyl)-2-methyl-2H-pyrazolo[3,4-d]pyrimidin-3,6-diamin [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 571.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.4±32.9 °C
Index of Refraction: 1.668
Molar Refractivity: 83.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.15
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 3.85
ACD/KOC (pH 5.5): 57.86
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 18.23
ACD/KOC (pH 7.4): 274.17
Polar Surface Area: 91 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 222.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement