ChemSpider 2D Image | Methyl 3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]-3-[2-(2-methoxy-2-oxoethoxy)phenyl]propanoate | C24H29NO8

Methyl 3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]-3-[2-(2-methoxy-2-oxoethoxy)phenyl]propanoate

  • Molecular FormulaC24H29NO8
  • Average mass459.489 Da
  • Monoisotopic mass459.189331 Da
  • ChemSpider ID34497126

More details:

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

3-[3-Hydroxy-4-oxo-6-(1-pipéridinylméthyl)-4H-pyran-2-yl]-3-[2-(2-méthoxy-2-oxoéthoxy)phényl]propanoate de méthyle [French] [ACD/IUPAC Name]
4H-Pyran-2-propanoic acid, 3-hydroxy-β-[2-(2-methoxy-2-oxoethoxy)phenyl]-4-oxo-6-(1-piperidinylmethyl)-, methyl ester [ACD/Index Name]
Methyl 3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]-3-[2-(2-methoxy-2-oxoethoxy)phenyl]propanoate [ACD/IUPAC Name]
Methyl-3-[3-hydroxy-4-oxo-6-(1-piperidinylmethyl)-4H-pyran-2-yl]-3-[2-(2-methoxy-2-oxoethoxy)phenyl]propanoat [German] [ACD/IUPAC Name]
1676097-82-7 [RN]
methyl 3-(3-hydroxy-4-oxo-6-(piperidin-1-ylmethyl)-4H-pyran-2-yl)-3-(2-(2-methoxy-2-oxoethoxy)phenyl)propanoate
methyl 3-[3-hydroxy-4-oxo-6-(piperidin-1-ylmethyl)pyran-2-yl]-3-[2-(2-methoxy-2-oxoethoxy)phenyl]propanoate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 630.7±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 98.0±3.0 kJ/mol
    Flash Point: 335.2±31.5 °C
    Index of Refraction: 1.575
    Molar Refractivity: 117.5±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 2.93
    ACD/LogD (pH 5.5): -0.89
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 2.20
    Polar Surface Area: 112 Å2
    Polarizability: 46.6±0.5 10-24cm3
    Surface Tension: 54.8±3.0 dyne/cm
    Molar Volume: 355.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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