ChemSpider 2D Image | 2,2'-[(5-Methyl-2-furyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one) | C18H16O7

2,2'-[(5-Methyl-2-furyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one)

  • Molecular FormulaC18H16O7
  • Average mass344.315 Da
  • Monoisotopic mass344.089600 Da
  • ChemSpider ID29770128

More details:

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

2,2'-[(5-Methyl-2-furyl)methylen]bis(3-hydroxy-6-methyl-4H-pyran-4-on) [German] [ACD/IUPAC Name]
2,2'-[(5-Methyl-2-furyl)methylene]bis(3-hydroxy-6-methyl-4H-pyran-4-one) [ACD/IUPAC Name]
2,2'-[(5-Méthyl-2-furyl)méthylène]bis(3-hydroxy-6-méthyl-4H-pyran-4-one) [French] [ACD/IUPAC Name]
4H-Pyran-4-one, 2,2'-[(5-methyl-2-furanyl)methylene]bis[3-hydroxy-6-methyl- [ACD/Index Name]
1435898-84-2 [RN]
3-HYDROXY-2-[(3-HYDROXY-6-METHYL-4-OXO-4H-PYRAN-2-YL)(5-METHYLFURAN-2-YL)METHYL]-6-METHYL-4H-PYRAN-4-ONE
3-hydroxy-2-[(3-hydroxy-6-methyl-4-oxopyran-2-yl)-(5-methylfuran-2-yl)methyl]-6-methylpyran-4-one
3-HYDROXY-2-[(3-HYDROXY-6-METHYL-4-OXOPYRAN-2-YL)(5-METHYLFURAN-2-YL)METHYL]-6-METHYLPYRAN-4-ONE

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 569.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 89.9±3.0 kJ/mol
    Flash Point: 298.3±30.1 °C
    Index of Refraction: 1.646
    Molar Refractivity: 84.9±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 2.16
    ACD/LogD (pH 5.5): 1.16
    ACD/BCF (pH 5.5): 4.49
    ACD/KOC (pH 5.5): 101.89
    ACD/LogD (pH 7.4): 1.00
    ACD/BCF (pH 7.4): 3.13
    ACD/KOC (pH 7.4): 71.03
    Polar Surface Area: 106 Å2
    Polarizability: 33.6±0.5 10-24cm3
    Surface Tension: 67.5±3.0 dyne/cm
    Molar Volume: 233.8±3.0 cm3

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