ChemSpider 2D Image | 5-Bromoisoxazolo[5,4-b]pyridin-3-amine | C6H4BrN3O

5-Bromoisoxazolo[5,4-b]pyridin-3-amine

  • Molecular FormulaC6H4BrN3O
  • Average mass214.020 Da
  • Monoisotopic mass212.953766 Da
  • ChemSpider ID24598285

More details:

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

1260880-81-6 [RN]
5-Brom[1,2]oxazolo[5,4-b]pyridin-3-amin [German] [ACD/IUPAC Name]
5-bromo-[1,2]oxazolo[5,4-b]pyridin-3-amine
5-Bromo[1,2]oxazolo[5,4-b]pyridin-3-amine [ACD/IUPAC Name]
5-Bromo[1,2]oxazolo[5,4-b]pyridin-3-amine [French] [ACD/IUPAC Name]
5-Bromoisoxazolo[5,4-b]pyridin-3-amine
Isoxazolo[5,4-b]pyridin-3-amine, 5-bromo- [ACD/Index Name]
5-bromo-isoxazolo[5,4-b]pyridin-3-ylamine
MFCD13193316

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

    Density: 1.9±0.1 g/cm3
    Boiling Point: 367.1±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.4±3.0 kJ/mol
    Flash Point: 175.8±26.5 °C
    Index of Refraction: 1.732
    Molar Refractivity: 44.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 0.05
    ACD/LogD (pH 5.5): 1.06
    ACD/BCF (pH 5.5): 3.76
    ACD/KOC (pH 5.5): 89.76
    ACD/LogD (pH 7.4): 1.06
    ACD/BCF (pH 7.4): 3.76
    ACD/KOC (pH 7.4): 89.76
    Polar Surface Area: 65 Å2
    Polarizability: 17.6±0.5 10-24cm3
    Surface Tension: 77.1±3.0 dyne/cm
    Molar Volume: 111.3±3.0 cm3

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