ChemSpider 2D Image | Desloratadine-d4 | C19H15D4ClN2

Desloratadine-d4

  • Molecular FormulaC19H15D4ClN2
  • Average mass314.845 Da
  • Monoisotopic mass314.148773 Da
  • ChemSpider ID23935836

  • Non-standard isotope - Non-standard isotope

More details:

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

381727-29-3 [RN]
5H-Benzo[5,6]cyclohepta[1,2-b]pyridine, 8-chloro-6,11-dihydro-11-(4-piperidinylidene-2,2,6,6-d4)- [ACD/Index Name]
8-Chlor-11-[(2,2,6,6-2H4)-4-piperidinyliden]-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridin [German] [ACD/IUPAC Name]
8-Chloro-11-[(2,2,6,6-2H4)-4-piperidinylidene]-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine [ACD/IUPAC Name]
8-Chloro-11-[(2,2,6,6-2H4)-4-pipéridinylidène]-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine [French] [ACD/IUPAC Name]
Desloratadine-d4
8-chloro-11-(2,2,6,6-tetradeuteriopiperidin-4-ylidene)-5,6-dihydrobenzo[1,2]cyclohepta[2,4-b]pyridine
8-Chloro-11-[(2,2,6,6-2H4)piperidin-4-ylidene]-6,11-dihydro-5H-benzo[5,6]cyclohepta[1,2-b]pyridine

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 467.9±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.0±3.0 kJ/mol
    Flash Point: 236.8±28.7 °C
    Index of Refraction: 1.626
    Molar Refractivity: 90.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 1
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 1
    ACD/LogP: 6.77
    ACD/LogD (pH 5.5): 1.70
    ACD/BCF (pH 5.5): 2.09
    ACD/KOC (pH 5.5): 7.73
    ACD/LogD (pH 7.4): 2.14
    ACD/BCF (pH 7.4): 5.76
    ACD/KOC (pH 7.4): 21.39
    Polar Surface Area: 25 Å2
    Polarizability: 35.7±0.5 10-24cm3
    Surface Tension: 50.0±3.0 dyne/cm
    Molar Volume: 254.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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