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Search term: MF = 'C_{17}H_{22}O_{4}S'

ChemSpider 2D Image | (1-Vinyl-2-oxabicyclo[2.2.2]oct-4-yl)methyl 4-methylbenzenesulfonate | C17H22O4S

(1-Vinyl-2-oxabicyclo[2.2.2]oct-4-yl)methyl 4-methylbenzenesulfonate

  • Molecular FormulaC17H22O4S
  • Average mass322.419 Da
  • Monoisotopic mass322.123871 Da
  • ChemSpider ID71117416

More details:






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

(1-Vinyl-2-oxabicyclo[2.2.2]oct-4-yl)methyl 4-methylbenzenesulfonate [ACD/IUPAC Name]
(1-Vinyl-2-oxabicyclo[2.2.2]oct-4-yl)methyl-4-methylbenzolsulfonat [German] [ACD/IUPAC Name]
2-Oxabicyclo[2.2.2]octane-4-methanol, 1-ethenyl-, 4-methylbenzenesulfonate [ACD/Index Name]
4-Méthylbenzènesulfonate de (1-vinyl-2-oxabicyclo[2.2.2]oct-4-yl)méthyle [French] [ACD/IUPAC Name]
(1-Vinyl-2-oxabicyclo[2.2.2]octan-4-yl)methyl 4-methylbenzenesulfonate
(1-Vinyl-2-oxabicyclo[2.2.2]octan-4-yl)methyl tosylate
{1-ethenyl-2-oxabicyclo[2.2.2]octan-4-yl}methyl 4-methylbenzene-1-sulfonate
{1-ethenyl-2-oxabicyclo[2.2.2]octan-4-yl}methyl 4-methylbenzenesulfonate
1417551-38-2 [RN]
MFCD28403781

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 438.2±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.8±3.0 kJ/mol
    Flash Point: 218.8±21.8 °C
    Index of Refraction: 1.589
    Molar Refractivity: 85.7±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.75
    ACD/LogD (pH 5.5): 3.29
    ACD/BCF (pH 5.5): 186.67
    ACD/KOC (pH 5.5): 1469.76
    ACD/LogD (pH 7.4): 3.29
    ACD/BCF (pH 7.4): 186.67
    ACD/KOC (pH 7.4): 1469.76
    Polar Surface Area: 61 Å2
    Polarizability: 34.0±0.5 10-24cm3
    Surface Tension: 52.9±3.0 dyne/cm
    Molar Volume: 254.2±3.0 cm3

    Click to predict properties on the Chemicalize site






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