ChemSpider 2D Image | 2-[4-(2,2-Difluoropropyl)-1-piperazinyl]nicotinonitrile | C13H16F2N4

2-[4-(2,2-Difluoropropyl)-1-piperazinyl]nicotinonitrile

  • Molecular FormulaC13H16F2N4
  • Average mass266.290 Da
  • Monoisotopic mass266.134308 Da
  • ChemSpider ID64906865

More details:

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

2-[4-(2,2-Difluoropropyl)-1-piperazinyl]nicotinonitrile [ACD/IUPAC Name]
2-[4-(2,2-Difluoropropyl)-1-pipérazinyl]nicotinonitrile [French] [ACD/IUPAC Name]
2-[4-(2,2-Difluorpropyl)-1-piperazinyl]nicotinonitril [German] [ACD/IUPAC Name]
3-Pyridinecarbonitrile, 2-[4-(2,2-difluoropropyl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 387.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.6±3.0 kJ/mol
Flash Point: 188.1±27.9 °C
Index of Refraction: 1.548
Molar Refractivity: 67.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.55
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 10.54
ACD/KOC (pH 5.5): 169.45
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 15.06
ACD/KOC (pH 7.4): 242.17
Polar Surface Area: 43 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 212.5±5.0 cm3

Click to predict properties on the Chemicalize site


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