ChemSpider 2D Image | (3S,5R)-1-(4-Hydroxy-3-methoxyphenyl)-3,5-decanediyl diacetate | C21H32O6

(3S,5R)-1-(4-Hydroxy-3-methoxyphenyl)-3,5-decanediyl diacetate

  • Molecular FormulaC21H32O6
  • Average mass380.475 Da
  • Monoisotopic mass380.219879 Da
  • ChemSpider ID64863398

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,5R)-1-(4-Hydroxy-3-methoxyphenyl)-3,5-decandiyl-diacetat [German] [ACD/IUPAC Name]
(3S,5R)-1-(4-Hydroxy-3-methoxyphenyl)-3,5-decanediyl diacetate [ACD/IUPAC Name]
3,5-Decanediol, 1-(4-hydroxy-3-methoxyphenyl)-, 3,5-diacetate, (3S,5R)- [ACD/Index Name]
Diacétate de (3S,5R)-1-(4-hydroxy-3-méthoxyphényl)-3,5-décanediyle [French] [ACD/IUPAC Name]
(3S,5R)-1-(4-hydroxy-3-methoxyphenyl)decane-3,5-diyl diacetate
143615-75-2 [RN]
Diacetoxy-6-gingerdiol

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 500.0±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.8±3.0 kJ/mol
    Flash Point: 164.9±23.6 °C
    Index of Refraction: 1.502
    Molar Refractivity: 103.4±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 14
    #Rule of 5 Violations: 0
    ACD/LogP: 4.32
    ACD/LogD (pH 5.5): 4.79
    ACD/BCF (pH 5.5): 2557.53
    ACD/KOC (pH 5.5): 9569.97
    ACD/LogD (pH 7.4): 4.79
    ACD/BCF (pH 7.4): 2552.55
    ACD/KOC (pH 7.4): 9551.32
    Polar Surface Area: 82 Å2
    Polarizability: 41.0±0.5 10-24cm3
    Surface Tension: 39.2±3.0 dyne/cm
    Molar Volume: 350.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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