ChemSpider 2D Image | MFCD08446365 | C11H8FN5

MFCD08446365

  • Molecular FormulaC11H8FN5
  • Average mass229.213 Da
  • Monoisotopic mass229.076370 Da
  • ChemSpider ID21499111

More details:

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

1-(2-FLUOROPHENYL)-1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINE
MFCD08446365

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

Density: 1.5±0.1 g/cm3
Boiling Point: 365.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.1±3.0 kJ/mol
Flash Point: 174.6±27.9 °C
Index of Refraction: 1.748
Molar Refractivity: 60.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.14
ACD/KOC (pH 5.5): 141.63
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 7.22
ACD/KOC (pH 7.4): 143.26
Polar Surface Area: 70 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 60.8±7.0 dyne/cm
Molar Volume: 148.8±7.0 cm3

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