ChemSpider 2D Image | Dimethyl (3E,3'E)-3,3'-{1,4-phenylenebis[imino(E)methylylidene]}bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate) | C28H32N2O8

Dimethyl (3E,3'E)-3,3'-{1,4-phenylenebis[imino(E)methylylidene]}bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate)

  • Molecular FormulaC28H32N2O8
  • Average mass524.562 Da
  • Monoisotopic mass524.215881 Da
  • ChemSpider ID2112175

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E,3'E)-3,3'-{1,4-Phénylènebis[imino(E)méthylylidène]}bis(6,6-diméthyl-2,4-dioxocyclohexanecarboxylate) de diméthyle [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 3,3'-[1,4-phenylenebis[imino(E)methylidyne]]bis[6,6-dimethyl-2,4-dioxo-, dimethyl ester, (3E,3'E)- [ACD/Index Name]
Dimethyl (3E,3'E)-3,3'-{1,4-phenylenebis[imino(E)methylylidene]}bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate) [ACD/IUPAC Name]
Dimethyl-(3E,3'E)-3,3'-{1,4-phenylenbis[imino(E)methylyliden]}bis(6,6-dimethyl-2,4-dioxocyclohexancarboxylat) [German] [ACD/IUPAC Name]
(5E,5'E)-dimethyl 5,5'-((1,4-phenylenebis(azanediyl))bis(methanylylidene))bis(2,2-dimethyl-4,6-dioxocyclohexanecarboxylate)
383410-26-2 [RN]
dimethyl (3E,3'E)-3,3'-{benzene-1,4-diylbis[imino(E)methylylidene]}bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate)
Dimethyl 3,3'-[1,4-phenylenebis(iminomethylylidene)]bis(6,6-dimethyl-2,4-dioxocyclohexanecarboxylate) [ACD/IUPAC Name]
methyl (5E)-5-[[4-[[(E)-(3-methoxycarbonyl-4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]amino]anilino]methylidene]-2,2-dimethyl-4,6-dioxocyclohexane-1-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 648.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 95.7±3.0 kJ/mol
    Flash Point: 346.2±31.5 °C
    Index of Refraction: 1.642
    Molar Refractivity: 141.0±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 1.19
    ACD/LogD (pH 5.5): 1.95
    ACD/BCF (pH 5.5): 17.72
    ACD/KOC (pH 5.5): 272.48
    ACD/LogD (pH 7.4): 1.95
    ACD/BCF (pH 7.4): 17.70
    ACD/KOC (pH 7.4): 272.16
    Polar Surface Area: 145 Å2
    Polarizability: 55.9±0.5 10-24cm3
    Surface Tension: 64.9±3.0 dyne/cm
    Molar Volume: 390.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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