ChemSpider 2D Image | (1aS,1bS,4aR,5R,6aS,7aR,9aR)-6a,9a-Dimethyl-4-methylene-3-oxododecahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-5-yl acetate | C17H22O6

(1aS,1bS,4aR,5R,6aS,7aR,9aR)-6a,9a-Dimethyl-4-methylene-3-oxododecahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-5-yl acetate

  • Molecular FormulaC17H22O6
  • Average mass322.353 Da
  • Monoisotopic mass322.141632 Da
  • ChemSpider ID28424297

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(1aS,1bS,4aR,5R,6aS,7aR,9aR)-6a,9a-Dimethyl-4-methylen-3-oxododecahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-5-yl-acetat [German] [ACD/IUPAC Name]
(1aS,1bS,4aR,5R,6aS,7aR,9aR)-6a,9a-Dimethyl-4-methylene-3-oxododecahydrobisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-5-yl acetate [ACD/IUPAC Name]
Acétate de (1aS,1bS,4aR,5R,6aS,7aR,9aR)-6a,9a-diméthyl-4-méthylène-3-oxododécahydrobisoxiréno[5,6:9,10]cyclodéca[1,2-b]furan-5-yle [French] [ACD/IUPAC Name]
Bisoxireno[5,6:9,10]cyclodeca[1,2-b]furan-3(1bH)-one, 5-(acetyloxy)decahydro-6a,9a-dimethyl-4-methylene-, (1aS,1bS,4aR,5R,6aS,7aR,9aR)- [ACD/Index Name]
[39815-40-2] [RN]
39815-40-2 [RN]
Epitulipinolide diepoxide
MFCD17214860

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 463.6±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 205.3±28.8 °C
    Index of Refraction: 1.544
    Molar Refractivity: 79.2±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.17
    ACD/LogD (pH 5.5): 0.78
    ACD/BCF (pH 5.5): 2.31
    ACD/KOC (pH 5.5): 63.30
    ACD/LogD (pH 7.4): 0.78
    ACD/BCF (pH 7.4): 2.31
    ACD/KOC (pH 7.4): 63.30
    Polar Surface Area: 78 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 45.7±5.0 dyne/cm
    Molar Volume: 251.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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