ChemSpider 2D Image | 2-{3-[3-(Difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}ethanamine | C11H11F2N3O2

2-{3-[3-(Difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}ethanamine

  • Molecular FormulaC11H11F2N3O2
  • Average mass255.221 Da
  • Monoisotopic mass255.081940 Da
  • ChemSpider ID32840983

More details:

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

1,2,4-Oxadiazole-5-ethanamine, 3-[3-(difluoromethoxy)phenyl]- [ACD/Index Name]
1779133-47-9 [RN]
2-{3-[3-(Difluormethoxy)phenyl]-1,2,4-oxadiazol-5-yl}ethanamin [German] [ACD/IUPAC Name]
2-{3-[3-(difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}ethan-1-amine
2-{3-[3-(Difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}ethanamine [ACD/IUPAC Name]
2-{3-[3-(Difluorométhoxy)phényl]-1,2,4-oxadiazol-5-yl}éthanamine [French] [ACD/IUPAC Name]
2-(3-(3-(Difluoromethoxy)phenyl)-1,2,4-oxadiazol-5-yl)ethanamine
2-[3-(3-Difluoromethoxy-phenyl)-[1,2,4]oxadiazol-5-yl]-ethylamine
2-[3-[3-(difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]ethanamine
MFCD26128430

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 387.6±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 63.7±3.0 kJ/mol
    Flash Point: 188.2±30.7 °C
    Index of Refraction: 1.519
    Molar Refractivity: 59.4±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.05
    ACD/LogD (pH 5.5): -0.99
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.72
    ACD/BCF (pH 7.4): 1.42
    ACD/KOC (pH 7.4): 28.89
    Polar Surface Area: 74 Å2
    Polarizability: 23.5±0.5 10-24cm3
    Surface Tension: 43.1±3.0 dyne/cm
    Molar Volume: 195.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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