ChemSpider 2D Image | 2,5-di-tert-butyl 3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylate | C22H26O7

2,5-di-tert-butyl 3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylate

  • Molecular FormulaC22H26O7
  • Average mass402.438 Da
  • Monoisotopic mass402.167847 Da
  • ChemSpider ID57388275

More details:

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

1332856-34-4 [RN]
2,5-di-tert-butyl 3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylate
3-(Benzyloxy)-4-oxo-4H-pyrane-2,5-dicarboxylate de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
4H-Pyran-2,5-dicarboxylic acid, 4-oxo-3-(phenylmethoxy)-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
Bis(2-methyl-2-propanyl) 3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylate [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylat [German] [ACD/IUPAC Name]
Di-tert-butyl 3-(benzyloxy)-4-oxo-4H-pyran-2,5-dicarboxylate
MFCD29921449

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 560.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.3±3.0 kJ/mol
    Flash Point: 242.6±30.2 °C
    Index of Refraction: 1.541
    Molar Refractivity: 105.3±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.13
    ACD/LogD (pH 5.5): 3.25
    ACD/BCF (pH 5.5): 174.18
    ACD/KOC (pH 5.5): 1398.67
    ACD/LogD (pH 7.4): 3.25
    ACD/BCF (pH 7.4): 174.18
    ACD/KOC (pH 7.4): 1398.67
    Polar Surface Area: 88 Å2
    Polarizability: 41.7±0.5 10-24cm3
    Surface Tension: 45.2±5.0 dyne/cm
    Molar Volume: 335.0±5.0 cm3

    Click to predict properties on the Chemicalize site


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