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Search term: YAMGDACIHVVKEF-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2,13-Dibromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine | C20H22Br2O6

2,13-Dibromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine

  • Molecular FormulaC20H22Br2O6
  • Average mass518.193 Da
  • Monoisotopic mass515.978271 Da
  • ChemSpider ID2826809

More details:

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

2,13-Dibrom-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin [German] [ACD/IUPAC Name]
2,13-Dibromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecine [ACD/IUPAC Name]
2,13-Dibromo-6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadécine [French] [ACD/IUPAC Name]
Dibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin, 2,13-dibromo-6,7,9,10,17,18,20,21-octahydro- [ACD/Index Name]
110692-06-3 [RN]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 573.5±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.8±3.0 kJ/mol
    Flash Point: 241.9±28.6 °C
    Index of Refraction: 1.534
    Molar Refractivity: 111.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 4.14
    ACD/LogD (pH 5.5): 3.83
    ACD/BCF (pH 5.5): 482.43
    ACD/KOC (pH 5.5): 2900.04
    ACD/LogD (pH 7.4): 3.83
    ACD/BCF (pH 7.4): 482.43
    ACD/KOC (pH 7.4): 2900.04
    Polar Surface Area: 55 Å2
    Polarizability: 44.0±0.5 10-24cm3
    Surface Tension: 43.0±3.0 dyne/cm
    Molar Volume: 357.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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