ChemSpider 2D Image | 5,9-Dihydroxy-2,2,11,11-tetramethyl-3,4,12,13-tetrahydro-2H-dipyrano[2,3-a:2',3'-j]xanthen-14(11H)-one | C23H24O6

5,9-Dihydroxy-2,2,11,11-tetramethyl-3,4,12,13-tetrahydro-2H-dipyrano[2,3-a:2',3'-j]xanthen-14(11H)-one

  • Molecular FormulaC23H24O6
  • Average mass396.433 Da
  • Monoisotopic mass396.157288 Da
  • ChemSpider ID28425545

More details:

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

2H-Dipyrano[2,3-a:2',3'-j]xanthen-14(11H)-one, 3,4,12,13-tetrahydro-5,9-dihydroxy-2,2,11,11-tetramethyl- [ACD/Index Name]
5,9-Dihydroxy-2,2,11,11-tetramethyl-3,4,12,13-tetrahydro-2H-dipyrano[2,3-a:2',3'-j]xanthen-14(11H)-on [German] [ACD/IUPAC Name]
5,9-Dihydroxy-2,2,11,11-tetramethyl-3,4,12,13-tetrahydro-2H-dipyrano[2,3-a:2',3'-j]xanthen-14(11H)-one [ACD/IUPAC Name]
5,9-Dihydroxy-2,2,11,11-tétraméthyl-3,4,12,13-tétrahydro-2H-dipyrano[2,3-a:2',3'-j]xanthén-14(11H)-one [French] [ACD/IUPAC Name]
[15404-80-5] [RN]
15404-80-5 [RN]
Isonormangostin
Isormangostin
MFCD20274905

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 606.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 93.5±3.0 kJ/mol
    Flash Point: 213.0±25.0 °C
    Index of Refraction: 1.613
    Molar Refractivity: 105.5±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 5.60
    ACD/LogD (pH 5.5): 5.42
    ACD/BCF (pH 5.5): 7706.40
    ACD/KOC (pH 5.5): 20935.38
    ACD/LogD (pH 7.4): 4.90
    ACD/BCF (pH 7.4): 2313.52
    ACD/KOC (pH 7.4): 6284.98
    Polar Surface Area: 85 Å2
    Polarizability: 41.8±0.5 10-24cm3
    Surface Tension: 50.6±3.0 dyne/cm
    Molar Volume: 303.0±3.0 cm3

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