ChemSpider 2D Image | 4-Methyl-10-[4-(octyloxy)phenyl]-9,10-dihydro-2H,8H-pyrano[2,3-f]chromene-2,8-dione | C27H30O5

4-Methyl-10-[4-(octyloxy)phenyl]-9,10-dihydro-2H,8H-pyrano[2,3-f]chromene-2,8-dione

  • Molecular FormulaC27H30O5
  • Average mass434.524 Da
  • Monoisotopic mass434.209320 Da
  • ChemSpider ID30717947

More details:

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

2H,8H-Benzo[1,2-b:3,4-b']dipyran-2,8-dione, 9,10-dihydro-4-methyl-10-[4-(octyloxy)phenyl]- [ACD/Index Name]
4-Methyl-10-[4-(octyloxy)phenyl]-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-2,8-dion [German] [ACD/IUPAC Name]
4-Methyl-10-[4-(octyloxy)phenyl]-9,10-dihydro-2H,8H-pyrano[2,3-f]chromene-2,8-dione [ACD/IUPAC Name]
4-Méthyl-10-[4-(octyloxy)phényl]-9,10-dihydro-2H,8H-pyrano[2,3-f]chromène-2,8-dione [French] [ACD/IUPAC Name]
1574345-41-7 [RN]
4-methyl-10-(4-(octyloxy)phenyl)-9,10-dihydropyrano[2,3-f]chromene-2,8-dione
4-methyl-10-(4-octoxyphenyl)-9,10-dihydropyrano[2,3-f]chromene-2,8-dione
MolPort-029-886-112

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 561.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.4±3.0 kJ/mol
    Flash Point: 240.1±30.2 °C
    Index of Refraction: 1.567
    Molar Refractivity: 121.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 7.11
    ACD/LogD (pH 5.5): 7.29
    ACD/BCF (pH 5.5): 205408.66
    ACD/KOC (pH 5.5): 220977.45
    ACD/LogD (pH 7.4): 7.29
    ACD/BCF (pH 7.4): 205408.66
    ACD/KOC (pH 7.4): 220977.45
    Polar Surface Area: 62 Å2
    Polarizability: 48.3±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 373.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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