ChemSpider 2D Image | 5-(2-Fluorophenyl)nicotinonitrile | C12H7FN2

5-(2-Fluorophenyl)nicotinonitrile

  • Molecular FormulaC12H7FN2
  • Average mass198.196 Da
  • Monoisotopic mass198.059326 Da
  • ChemSpider ID23356684

More details:

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

3-Pyridinecarbonitrile, 5-(2-fluorophenyl)- [ACD/Index Name]
5-(2-Fluorophenyl)nicotinonitrile [ACD/IUPAC Name]
5-(2-Fluorophényl)nicotinonitrile [French] [ACD/IUPAC Name]
5-(2-Fluorphenyl)nicotinonitril [German] [ACD/IUPAC Name]
1214334-11-8 [RN]
5-(2-fluorophenyl)pyridine-3-carbonitrile
MFCD14698982 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 331.4±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.4±3.0 kJ/mol
Flash Point: 154.2±25.1 °C
Index of Refraction: 1.599
Molar Refractivity: 53.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 2.53
ACD/BCF (pH 5.5): 49.01
ACD/KOC (pH 5.5): 564.28
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 49.01
ACD/KOC (pH 7.4): 564.29
Polar Surface Area: 37 Å2
Polarizability: 21.4±0.5 10-24cm3
Surface Tension: 54.0±5.0 dyne/cm
Molar Volume: 157.9±5.0 cm3

Click to predict properties on the Chemicalize site


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