ChemSpider 2D Image | 4-[(3E)-3-(3,4-Dihydroxybenzylidene)-2,5-dioxo-1-pyrrolidinyl]phenyl acetate | C19H15NO6

4-[(3E)-3-(3,4-Dihydroxybenzylidene)-2,5-dioxo-1-pyrrolidinyl]phenyl acetate

  • Molecular FormulaC19H15NO6
  • Average mass353.326 Da
  • Monoisotopic mass353.089935 Da
  • ChemSpider ID22884593

  • Double-bond stereo - Double-bond stereo

More details:

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

2,5-Pyrrolidinedione, 1-[4-(acetyloxy)phenyl]-3-[(3,4-dihydroxyphenyl)methylene]-, (3E)- [ACD/Index Name]
4-[(3E)-3-(3,4-Dihydroxybenzyliden)-2,5-dioxo-1-pyrrolidinyl]phenyl-acetat [German] [ACD/IUPAC Name]
4-[(3E)-3-(3,4-Dihydroxybenzylidene)-2,5-dioxo-1-pyrrolidinyl]phenyl acetate [ACD/IUPAC Name]
Acétate de 4-[(3E)-3-(3,4-dihydroxybenzylidène)-2,5-dioxo-1-pyrrolidinyl]phényle [French] [ACD/IUPAC Name]
(E)-4-(3-(3,4-dihydroxybenzylidene)-2,5-dioxopyrrolidin-1-yl)phenyl acetate
[4-[(3E)-3-[(3,4-dihydroxyphenyl)methylidene]-2,5-dioxopyrrolidin-1-yl]phenyl] acetate
4-[(3E)-3-(3,4-dihydroxybenzylidene)-2,5-dioxopyrrolidin-1-yl]phenyl acetate
929820-28-0 [RN]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 593.6±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 91.8±3.0 kJ/mol
    Flash Point: 312.8±32.9 °C
    Index of Refraction: 1.700
    Molar Refractivity: 92.5±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.28
    ACD/LogD (pH 5.5): 1.18
    ACD/BCF (pH 5.5): 4.68
    ACD/KOC (pH 5.5): 105.01
    ACD/LogD (pH 7.4): 1.17
    ACD/BCF (pH 7.4): 4.48
    ACD/KOC (pH 7.4): 100.55
    Polar Surface Area: 104 Å2
    Polarizability: 36.7±0.5 10-24cm3
    Surface Tension: 74.6±3.0 dyne/cm
    Molar Volume: 239.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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