Found 123 results

Search term: MF = 'C_{31}H_{36}N_{2}O_{8}'
ChemSpider 2D Image | (4E)-5-[4-(Allyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione | C31H36N2O8

(4E)-5-[4-(Allyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione

  • Molecular FormulaC31H36N2O8
  • Average mass564.626 Da
  • Monoisotopic mass564.247192 Da
  • ChemSpider ID4708557

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-5-[4-(Allyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylen]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidindion [German] [ACD/IUPAC Name]
(4E)-5-[4-(Allyloxy)-3-ethoxyphenyl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)methylene]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [ACD/IUPAC Name]
(4E)-5-[4-(Allyloxy)-3-éthoxyphényl]-4-[2,3-dihydro-1,4-benzodioxin-6-yl(hydroxy)méthylène]-1-[3-(4-morpholinyl)propyl]-2,3-pyrrolidinedione [French] [ACD/IUPAC Name]
(E)-{2-[4-(Allyloxy)-3-ethoxyphenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,3-dihydro-1,4-benzodioxin-6-yl)methanolate
2,3-Pyrrolidinedione, 4-[(2,3-dihydro-1,4-benzodioxin-6-yl)hydroxymethylene]-5-[3-ethoxy-4-(2-propen-1-yloxy)phenyl]-1-[3-(4-morpholinyl)propyl]-, (4E)- [ACD/Index Name]
morpholinium, 4-[3-[(3E)-3-[(2,3-dihydro-1,4-benzodioxin-6-yl)hydroxymethylene]-2-[3-ethoxy-4-(2-propen-1-yloxy)phenyl]-4,5-dioxo-1-pyrrolidinyl]propyl]-, inner salt
(E)-2,3-dihydro-1,4-benzodioxin-6-yl-[2-(3-ethoxy-4-prop-2-enoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]methanolate
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{2-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
1026802-32-3 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 724.5±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 111.1±3.0 kJ/mol
    Flash Point: 391.9±35.7 °C
    Index of Refraction: 1.592
    Molar Refractivity: 150.9±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 1
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 3.86
    ACD/LogD (pH 5.5): 0.99
    ACD/BCF (pH 5.5): 1.38
    ACD/KOC (pH 5.5): 15.66
    ACD/LogD (pH 7.4): 2.27
    ACD/BCF (pH 7.4): 26.35
    ACD/KOC (pH 7.4): 297.93
    Polar Surface Area: 107 Å2
    Polarizability: 59.8±0.5 10-24cm3
    Surface Tension: 51.1±3.0 dyne/cm
    Molar Volume: 445.8±3.0 cm3

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