ChemSpider 2D Image | 3-(2,2,2-Trifluoroethyl)pyridine | C7H6F3N

3-(2,2,2-Trifluoroethyl)pyridine

  • Molecular FormulaC7H6F3N
  • Average mass161.124 Da
  • Monoisotopic mass161.045227 Da
  • ChemSpider ID21436722

More details:






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

3-(2,2,2-Trifluorethyl)pyridin [German] [ACD/IUPAC Name]
3-(2,2,2-Trifluoroethyl)pyridine [ACD/IUPAC Name]
3-(2,2,2-Trifluoroéthyl)pyridine [French] [ACD/IUPAC Name]
Pyridine, 3-(2,2,2-trifluoroethyl)- [ACD/Index Name]
[1099598-09-0]
1099598-09-0 [RN]
MFCD11100551 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 147.5±40.0 °C at 760 mmHg
Vapour Pressure: 5.6±0.3 mmHg at 25°C
Enthalpy of Vaporization: 36.9±3.0 kJ/mol
Flash Point: 43.0±27.3 °C
Index of Refraction: 1.434
Molar Refractivity: 34.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.88
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 7.95
ACD/KOC (pH 5.5): 149.70
ACD/LogD (pH 7.4): 1.54
ACD/BCF (pH 7.4): 8.66
ACD/KOC (pH 7.4): 163.09
Polar Surface Area: 13 Å2
Polarizability: 13.6±0.5 10-24cm3
Surface Tension: 27.4±3.0 dyne/cm
Molar Volume: 131.9±3.0 cm3

Click to predict properties on the Chemicalize site






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