ChemSpider 2D Image | (4-Methyltetrahydro-2H-pyran-4-yl)methyl methanesulfonate | C8H16O4S

(4-Methyltetrahydro-2H-pyran-4-yl)methyl methanesulfonate

  • Molecular FormulaC8H16O4S
  • Average mass208.275 Da
  • Monoisotopic mass208.076935 Da
  • ChemSpider ID58257166

More details:

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

(4-Methyltetrahydro-2H-pyran-4-yl)methyl methanesulfonate [ACD/IUPAC Name]
(4-Methyltetrahydro-2H-pyran-4-yl)methyl-methansulfonat [German] [ACD/IUPAC Name]
2H-Pyran-4-methanol, tetrahydro-4-methyl-, methanesulfonate [ACD/Index Name]
Méthanesulfonate de (4-méthyltétrahydro-2H-pyran-4-yl)méthyle [French] [ACD/IUPAC Name]
(4-METHYLOXAN-4-YL)METHYL METHANESULFONATE
1010836-62-0 [RN]
MFCD30481386

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 333.4±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.3±3.0 kJ/mol
    Flash Point: 155.5±20.4 °C
    Index of Refraction: 1.458
    Molar Refractivity: 49.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.41
    ACD/LogD (pH 5.5): 1.01
    ACD/BCF (pH 5.5): 3.46
    ACD/KOC (pH 5.5): 84.70
    ACD/LogD (pH 7.4): 1.01
    ACD/BCF (pH 7.4): 3.46
    ACD/KOC (pH 7.4): 84.70
    Polar Surface Area: 61 Å2
    Polarizability: 19.6±0.5 10-24cm3
    Surface Tension: 40.2±3.0 dyne/cm
    Molar Volume: 180.9±3.0 cm3

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