ChemSpider 2D Image | 5-Chloro-2-fluoro-3-(trifluoromethyl)pyridine | C6H2ClF4N

5-Chloro-2-fluoro-3-(trifluoromethyl)pyridine

  • Molecular FormulaC6H2ClF4N
  • Average mass199.533 Da
  • Monoisotopic mass198.981186 Da
  • ChemSpider ID14624046

More details:






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

5-Chlor-2-fluor-3-(trifluormethyl)pyridin [German] [ACD/IUPAC Name]
5-Chloro-2-fluoro-3-(trifluoromethyl)pyridine [ACD/IUPAC Name]
5-Chloro-2-fluoro-3-(trifluorométhyl)pyridine [French] [ACD/IUPAC Name]
71701-96-7 [RN]
Pyridine, 5-chloro-2-fluoro-3-(trifluoromethyl)- [ACD/Index Name]
[71701-96-7] [RN]
95%
DS-15855
MFCD09749652 [MDL number]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 164.6±35.0 °C at 760 mmHg
    Vapour Pressure: 2.6±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 38.5±3.0 kJ/mol
    Flash Point: 53.3±25.9 °C
    Index of Refraction: 1.430
    Molar Refractivity: 34.2±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.82
    ACD/LogD (pH 5.5): 2.41
    ACD/BCF (pH 5.5): 40.04
    ACD/KOC (pH 5.5): 488.26
    ACD/LogD (pH 7.4): 2.41
    ACD/BCF (pH 7.4): 40.04
    ACD/KOC (pH 7.4): 488.26
    Polar Surface Area: 13 Å2
    Polarizability: 13.6±0.5 10-24cm3
    Surface Tension: 27.0±3.0 dyne/cm
    Molar Volume: 132.3±3.0 cm3

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