ChemSpider 2D Image | 2-[3-(2-Fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]nicotinonitrile | C16H12FN3

2-[3-(2-Fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]nicotinonitrile

  • Molecular FormulaC16H12FN3
  • Average mass265.285 Da
  • Monoisotopic mass265.101532 Da
  • ChemSpider ID62264937

More details:

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

2-[3-(2-Fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]nicotinonitrile [ACD/IUPAC Name]
2-[3-(2-Fluorophényl)-2,5-dihydro-1H-pyrrol-1-yl]nicotinonitrile [French] [ACD/IUPAC Name]
2-[3-(2-Fluorphenyl)-2,5-dihydro-1H-pyrrol-1-yl]nicotinonitril [German] [ACD/IUPAC Name]
3-Pyridinecarbonitrile, 2-[3-(2-fluorophenyl)-2,5-dihydro-1H-pyrrol-1-yl]- [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: 450.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.9±3.0 kJ/mol
Flash Point: 226.0±28.7 °C
Index of Refraction: 1.645
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.64
ACD/LogD (pH 5.5): 3.05
ACD/BCF (pH 5.5): 121.45
ACD/KOC (pH 5.5): 1078.82
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 122.10
ACD/KOC (pH 7.4): 1084.61
Polar Surface Area: 40 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 204.0±5.0 cm3

Click to predict properties on the Chemicalize site


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