ChemSpider 2D Image | 5-Bromo-2-isopropoxy-3-methoxypyridine | C9H12BrNO2

5-Bromo-2-isopropoxy-3-methoxypyridine

  • Molecular FormulaC9H12BrNO2
  • Average mass246.101 Da
  • Monoisotopic mass245.005127 Da
  • ChemSpider ID26528165

More details:

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

1241752-33-9 [RN]
5-Brom-2-isopropoxy-3-methoxypyridin [German] [ACD/IUPAC Name]
5-Bromo-2-isopropoxy-3-methoxypyridine [ACD/IUPAC Name]
5-Bromo-2-isopropoxy-3-méthoxypyridine [French] [ACD/IUPAC Name]
Pyridine, 5-bromo-3-methoxy-2-(1-methylethoxy)- [ACD/Index Name]
5-BROMO-3-METHOXY-2-(PROPAN-2-YLOXY)PYRIDINE
5-Bromo-3-methoxy-2-[(propan-2-yl)oxy]pyridine
5-bromo-3-methoxy-2-propan-2-yloxypyridine
MFCD19688667 [MDL number]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 253.5±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.1±3.0 kJ/mol
    Flash Point: 107.1±25.9 °C
    Index of Refraction: 1.518
    Molar Refractivity: 54.6±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.86
    ACD/LogD (pH 5.5): 2.62
    ACD/BCF (pH 5.5): 57.37
    ACD/KOC (pH 5.5): 627.08
    ACD/LogD (pH 7.4): 2.63
    ACD/BCF (pH 7.4): 58.84
    ACD/KOC (pH 7.4): 643.14
    Polar Surface Area: 31 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 36.2±3.0 dyne/cm
    Molar Volume: 180.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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