ChemSpider 2D Image | [(1R)-4-(4-Methoxyphenyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methanol | C17H22O3

[(1R)-4-(4-Methoxyphenyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methanol

  • Molecular FormulaC17H22O3
  • Average mass274.355 Da
  • Monoisotopic mass274.156891 Da
  • ChemSpider ID64849991

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

[(1R)-4-(4-Methoxyphenyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methanol [German] [ACD/IUPAC Name]
[(1R)-4-(4-Methoxyphenyl)-6-methyl-3-oxabicyclo[3.3.1]non-6-en-1-yl]methanol [ACD/IUPAC Name]
[(1R)-4-(4-Méthoxyphényl)-6-méthyl-3-oxabicyclo[3.3.1]non-6-én-1-yl]méthanol [French] [ACD/IUPAC Name]
3-Oxabicyclo[3.3.1]non-6-ene-1-methanol, 4-(4-methoxyphenyl)-6-methyl-, (1R)- [ACD/Index Name]
[(1R,5R)-8-(4-methoxyphenyl)-2-methyl-7-oxabicyclo[3.3.1]non-2-en-5-yl]methanol
1212448-62-8 [RN]

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 397.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.3±3.0 kJ/mol
    Flash Point: 193.9±27.9 °C
    Index of Refraction: 1.552
    Molar Refractivity: 78.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.86
    ACD/LogD (pH 5.5): 3.30
    ACD/BCF (pH 5.5): 188.75
    ACD/KOC (pH 5.5): 1481.47
    ACD/LogD (pH 7.4): 3.30
    ACD/BCF (pH 7.4): 188.75
    ACD/KOC (pH 7.4): 1481.47
    Polar Surface Area: 39 Å2
    Polarizability: 31.0±0.5 10-24cm3
    Surface Tension: 40.6±3.0 dyne/cm
    Molar Volume: 244.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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