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Search term: 402505-60-6 (Found by approved synonym)
ChemSpider 2D Image | Diethyl-2,2':6',2'':6'',2'''-quaterpyridin-4',4''-dicarboxylat | C26H22N4O4

Diethyl-2,2':6',2'':6'',2'''-quaterpyridin-4',4''-dicarboxylat

  • Molecular FormulaC26H22N4O4
  • Average mass454.477 Da
  • Monoisotopic mass454.164093 Da
  • ChemSpider ID21428908

More details:

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

[2,2':6',2'':6'',2'''-Quaterpyridine]-4',4''-dicarboxylic acid, diethyl ester [ACD/Index Name]
2,2':6',2'':6'',2'''-Quaterpyridine-4',4''-dicarboxylate de diéthyle
2,2':6',2'':6'',2'''-Quaterpyridine-4',4''-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
402505-60-6 [RN]
Diethyl 2,2':6',2'':6'',2'''-quaterpyridine-4',4''-dicarboxylate [ACD/IUPAC Name]
Diethyl-2,2':6',2'':6'',2'''-quaterpyridin-4',4''-dicarboxylat
Diethyl-2,2':6',2'':6'',2'''-quaterpyridin-4',4''-dicarboxylat [German] [ACD/IUPAC Name]
DIETHYL 2,2':6',2':6',2'-QUATERPYRIDINE-4',4'-DICARBOXYLATE
MFCD14636241

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 652.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.2±3.0 kJ/mol
    Flash Point: 348.6±31.5 °C
    Index of Refraction: 1.598
    Molar Refractivity: 125.2±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.35
    ACD/LogD (pH 5.5): 4.44
    ACD/BCF (pH 5.5): 1401.35
    ACD/KOC (pH 5.5): 6221.27
    ACD/LogD (pH 7.4): 4.44
    ACD/BCF (pH 7.4): 1401.55
    ACD/KOC (pH 7.4): 6222.15
    Polar Surface Area: 104 Å2
    Polarizability: 49.6±0.5 10-24cm3
    Surface Tension: 53.7±3.0 dyne/cm
    Molar Volume: 367.0±3.0 cm3

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