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Search term: OGCIFXITFIVLND (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2,13-Bis(2-methyl-2-butanyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine | C30H44O6

2,13-Bis(2-methyl-2-butanyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

  • Molecular FormulaC30H44O6
  • Average mass500.667 Da
  • Monoisotopic mass500.313782 Da
  • ChemSpider ID2560124

More details:

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

2,13-Bis(2-methyl-2-butanyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin [German] [ACD/IUPAC Name]
2,13-Bis(2-methyl-2-butanyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine [ACD/IUPAC Name]
2,13-Bis(2-méthyl-2-butanyl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadécine [French] [ACD/IUPAC Name]
2,13-Bis(2-methylbutan-2-yl)-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine
Dibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin, 2,13-bis(1,1-dimethylpropyl)-6,7,9,10,17,18,20,21-octahydro- [ACD/Index Name]
110912-18-0 [RN]
2,13-di-tert-pentyl-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 588.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 84.6±3.0 kJ/mol
    Flash Point: 221.4±30.0 °C
    Index of Refraction: 1.488
    Molar Refractivity: 141.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 2
    ACD/LogP: 6.28
    ACD/LogD (pH 5.5): 5.92
    ACD/BCF (pH 5.5): 18598.88
    ACD/KOC (pH 5.5): 39599.10
    ACD/LogD (pH 7.4): 5.92
    ACD/BCF (pH 7.4): 18598.88
    ACD/KOC (pH 7.4): 39599.10
    Polar Surface Area: 55 Å2
    Polarizability: 56.2±0.5 10-24cm3
    Surface Tension: 34.4±3.0 dyne/cm
    Molar Volume: 491.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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