ChemSpider 2D Image | Dinonyl 5,6'-dimethyl-2,2'-biquinoline-4,4'-dicarboxylate | C40H52N2O4

Dinonyl 5,6'-dimethyl-2,2'-biquinoline-4,4'-dicarboxylate

  • Molecular FormulaC40H52N2O4
  • Average mass624.852 Da
  • Monoisotopic mass624.392700 Da
  • ChemSpider ID4201378

More details:

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

[2,2'-Biquinoline]-4,4'-dicarboxylic acid, 5,6'-dimethyl-, dinonyl ester [ACD/Index Name]
5,6'-Diméthyl-2,2'-biquinoléine-4,4'-dicarboxylate de dinonyle [French] [ACD/IUPAC Name]
Dinonyl 5,6'-dimethyl-2,2'-biquinoline-4,4'-dicarboxylate [ACD/IUPAC Name]
Dinonyl-5,6'-dimethyl-2,2'-bichinolin-4,4'-dicarboxylat [German] [ACD/IUPAC Name]
nonyl 5-methyl-2-(6-methyl-4-nonoxycarbonylquinolin-2-yl)quinoline-4-carboxylate

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 731.2±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.7±3.0 kJ/mol
    Flash Point: 396.0±32.9 °C
    Index of Refraction: 1.567
    Molar Refractivity: 190.0±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 21
    #Rule of 5 Violations: 2
    ACD/LogP: 13.66
    ACD/LogD (pH 5.5): 13.46
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 13.46
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 78 Å2
    Polarizability: 75.3±0.5 10-24cm3
    Surface Tension: 44.0±3.0 dyne/cm
    Molar Volume: 581.8±3.0 cm3

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