ChemSpider 2D Image | 3-[4-(2-Fluorophenyl)-3,6-dihydro-1(2H)-pyridinyl]-2-pyrazinecarbonitrile | C16H13FN4

3-[4-(2-Fluorophenyl)-3,6-dihydro-1(2H)-pyridinyl]-2-pyrazinecarbonitrile

  • Molecular FormulaC16H13FN4
  • Average mass280.300 Da
  • Monoisotopic mass280.112427 Da
  • ChemSpider ID30138923

More details:

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

2-Pyrazinecarbonitrile, 3-[4-(2-fluorophenyl)-3,6-dihydro-1(2H)-pyridinyl]- [ACD/Index Name]
3-[4-(2-Fluorophenyl)-3,6-dihydro-1(2H)-pyridinyl]-2-pyrazinecarbonitrile [ACD/IUPAC Name]
3-[4-(2-Fluorophényl)-3,6-dihydro-1(2H)-pyridinyl]-2-pyrazinecarbonitrile [French] [ACD/IUPAC Name]
3-[4-(2-Fluorphenyl)-3,6-dihydro-1(2H)-pyridinyl]-2-pyrazincarbonitril [German] [ACD/IUPAC 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: 474.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.8±3.0 kJ/mol
Flash Point: 240.7±28.7 °C
Index of Refraction: 1.636
Molar Refractivity: 76.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 2.43
ACD/BCF (pH 5.5): 41.45
ACD/KOC (pH 5.5): 500.56
ACD/LogD (pH 7.4): 2.43
ACD/BCF (pH 7.4): 41.45
ACD/KOC (pH 7.4): 500.56
Polar Surface Area: 53 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 64.8±5.0 dyne/cm
Molar Volume: 213.1±5.0 cm3

Click to predict properties on the Chemicalize site


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