ChemSpider 2D Image | 4-Bromo-4-methyloxane | C6H11BrO

4-Bromo-4-methyloxane

  • Molecular FormulaC6H11BrO
  • Average mass179.055 Da
  • Monoisotopic mass177.999313 Da
  • ChemSpider ID57471495

More details:

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

2H-Pyran, 4-bromotetrahydro-4-methyl- [ACD/Index Name]
4-Brom-4-methyltetrahydro-2H-pyran [German] [ACD/IUPAC Name]
4-Bromo-4-methyloxane
4-Bromo-4-methyltetrahydro-2H-pyran [ACD/IUPAC Name]
4-Bromo-4-méthyltétrahydro-2H-pyrane [French] [ACD/IUPAC Name]
66299-88-5 [RN]
4-Bromo-4-methyltetrahydropyran
CS-12876
MFCD30544174

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 181.5±33.0 °C at 760 mmHg
    Vapour Pressure: 1.2±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 40.1±3.0 kJ/mol
    Flash Point: 70.7±26.5 °C
    Index of Refraction: 1.481
    Molar Refractivity: 37.1±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.67
    ACD/LogD (pH 5.5): 1.88
    ACD/BCF (pH 5.5): 15.68
    ACD/KOC (pH 5.5): 249.54
    ACD/LogD (pH 7.4): 1.88
    ACD/BCF (pH 7.4): 15.68
    ACD/KOC (pH 7.4): 249.54
    Polar Surface Area: 9 Å2
    Polarizability: 14.7±0.5 10-24cm3
    Surface Tension: 32.1±3.0 dyne/cm
    Molar Volume: 130.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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