ChemSpider 2D Image | 6-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy}acetyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one | C28H23NO7

6-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy}acetyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one

  • Molecular FormulaC28H23NO7
  • Average mass485.485 Da
  • Monoisotopic mass485.147461 Da
  • ChemSpider ID30719893

More details:

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

2H-1,4-Benzoxazin-3(4H)-one, 6-[2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-benzofuranyl]oxy]acetyl]-4-methyl- [ACD/Index Name]
6-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy}acetyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-on [German] [ACD/IUPAC Name]
6-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy}acetyl)-4-methyl-2H-1,4-benzoxazin-3(4H)-one [ACD/IUPAC Name]
6-(2-{[3-(3,4-Dihydro-2H-1,5-benzodioxépin-7-yl)-1-benzofuran-5-yl]oxy}acétyl)-4-méthyl-2H-1,4-benzoxazin-3(4H)-one [French] [ACD/IUPAC Name]
1574299-86-7 [RN]
6-(2-((3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)benzofuran-5-yl)oxy)acetyl)-4-methyl-2H-benzo[b][1,4]oxazin-3(4H)-one
6-[2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-benzofuran-5-yl]oxy]acetyl]-4-methyl-1,4-benzoxazin-3-one
MolPort-029-883-815
STL408271

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 784.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 114.1±3.0 kJ/mol
    Flash Point: 428.1±32.9 °C
    Index of Refraction: 1.635
    Molar Refractivity: 130.2±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 3.39
    ACD/BCF (pH 5.5): 222.39
    ACD/KOC (pH 5.5): 1666.01
    ACD/LogD (pH 7.4): 3.39
    ACD/BCF (pH 7.4): 222.40
    ACD/KOC (pH 7.4): 1666.02
    Polar Surface Area: 87 Å2
    Polarizability: 51.6±0.5 10-24cm3
    Surface Tension: 53.2±3.0 dyne/cm
    Molar Volume: 363.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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