ChemSpider 2D Image | 1,4-Butanediyl bis[2-methyl-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate] | C36H40N2O8

1,4-Butanediyl bis[2-methyl-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate]

  • Molecular FormulaC36H40N2O8
  • Average mass628.711 Da
  • Monoisotopic mass628.278442 Da
  • ChemSpider ID3149257

More details:

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

1,4-Butandiyl-bis[2-methyl-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-chinolincarboxylat] [German] [ACD/IUPAC Name]
1,4-Butanediyl bis[2-methyl-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate] [ACD/IUPAC Name]
3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-2-methyl-4-(5-methyl-2-furanyl)-5-oxo-, 1,4-butanediyl ester [ACD/Index Name]
Bis[2-méthyl-4-(5-méthyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinoléinecarboxylate] de 1,4-butanediyle [French] [ACD/IUPAC Name]
Butane-1,4-diyl bis[2-methyl-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
4-[2-methyl-4-(5-methyl(2-furyl))-5-oxo-3-1,4,6,7,8-pentahydroquinolylcarbonyloxy]butyl 2-methyl-4-(5-methyl(2-furyl))-5-oxo-1,4,6,7,8-pentahydroquinoline-3-carboxylate
599150-40-0 [RN]
butane-1,4-diyl bis(2-methyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate)
butane-1,4-diyl bis[2-methyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]

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

A3095/0130997 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 784.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 114.1±3.0 kJ/mol
    Flash Point: 428.1±32.9 °C
    Index of Refraction: 1.612
    Molar Refractivity: 166.9±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 2
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 2
    ACD/LogP: 3.14
    ACD/LogD (pH 5.5): 4.68
    ACD/BCF (pH 5.5): 2114.79
    ACD/KOC (pH 5.5): 8352.44
    ACD/LogD (pH 7.4): 4.68
    ACD/BCF (pH 7.4): 2114.95
    ACD/KOC (pH 7.4): 8353.06
    Polar Surface Area: 137 Å2
    Polarizability: 66.2±0.5 10-24cm3
    Surface Tension: 57.7±5.0 dyne/cm
    Molar Volume: 479.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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