ChemSpider 2D Image | (3aS,4R,6aR)-1,4-Bis(3,4-dimethoxyphenyl)dihydro-1H,3H-furo[3,4-c]furan-3a(4H)-ol | C22H26O7

(3aS,4R,6aR)-1,4-Bis(3,4-dimethoxyphenyl)dihydro-1H,3H-furo[3,4-c]furan-3a(4H)-ol

  • Molecular FormulaC22H26O7
  • Average mass402.438 Da
  • Monoisotopic mass402.167847 Da
  • ChemSpider ID22906469

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(3aS,4R,6aR)-1,4-Bis(3,4-dimethoxyphenyl)dihydro-1H,3H-furo[3,4-c]furan-3a(4H)-ol [ACD/IUPAC Name]
(3aS,4R,6aR)-1,4-Bis(3,4-dimethoxyphenyl)dihydro-1H,3H-furo[3,4-c]furan-3a(4H)-ol [German] [ACD/IUPAC Name]
(3aS,4R,6aR)-1,4-Bis(3,4-diméthoxyphényl)dihydro-1H,3H-furo[3,4-c]furan-3a(4H)-ol [French] [ACD/IUPAC Name]
1H,3H-Furo[3,4-c]furan-3a(4H)-ol, 1,4-bis(3,4-dimethoxyphenyl)dihydro-, (3aS,4R,6aR)- [ACD/Index Name]
(3R,3aS,6aR)-3,6-bis(3,4-dimethoxyphenyl)-3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-ol
Gmelinol

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 560.3±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 88.7±3.0 kJ/mol
    Flash Point: 292.7±30.1 °C
    Index of Refraction: 1.574
    Molar Refractivity: 106.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.11
    ACD/LogD (pH 5.5): 2.67
    ACD/BCF (pH 5.5): 62.74
    ACD/KOC (pH 5.5): 673.39
    ACD/LogD (pH 7.4): 2.67
    ACD/BCF (pH 7.4): 62.73
    ACD/KOC (pH 7.4): 673.39
    Polar Surface Area: 76 Å2
    Polarizability: 42.0±0.5 10-24cm3
    Surface Tension: 47.1±3.0 dyne/cm
    Molar Volume: 321.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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