ChemSpider 2D Image | 3-Hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-isobutoxybenzoyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one | C26H31NO7

3-Hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-isobutoxybenzoyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC26H31NO7
  • Average mass469.527 Da
  • Monoisotopic mass469.210052 Da
  • ChemSpider ID21525893

More details:

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

2H-Pyrrol-2-one, 1,5-dihydro-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-(3-methoxypropyl)-4-[4-(2-methylpropoxy)benzoyl]- [ACD/Index Name]
3-Hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-isobutoxybenzoyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
3-Hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-isobutoxybenzoyl)-1-(3-methoxypropyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
3-Hydroxy-5-(4-hydroxy-3-méthoxyphényl)-4-(4-isobutoxybenzoyl)-1-(3-méthoxypropyl)-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-(3-methoxypropyl)-4-{[4-(2-methylpropoxy)phenyl]carbonyl}-1,5-dihydro-2H-pyrrol-2-one
3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1-(3-methoxypropyl)-4-{[4-(2-methylpropoxy)phenyl]carbonyl}-3-pyrrolin-2-one
3-Hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-4-(4-isobutoxy-benzoyl)-1-(3-methoxy-propyl)-1,5-dihydro-pyrrol-2-one
3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(4-isobutoxybenzoyl)-1-(3-methoxypropyl)-1H-pyrrol-2(5H)-one
848063-70-7 [RN]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 668.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 103.3±3.0 kJ/mol
    Flash Point: 358.3±31.5 °C
    Index of Refraction: 1.588
    Molar Refractivity: 126.9±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 0
    ACD/LogP: 3.48
    ACD/LogD (pH 5.5): 1.72
    ACD/BCF (pH 5.5): 6.68
    ACD/KOC (pH 5.5): 68.58
    ACD/LogD (pH 7.4): -0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.18
    Polar Surface Area: 106 Å2
    Polarizability: 50.3±0.5 10-24cm3
    Surface Tension: 51.8±3.0 dyne/cm
    Molar Volume: 377.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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