ChemSpider 2D Image | (3alpha)-(13,13,13-~2~H_3_)Galanthamine | C17H18D3NO3

(3α)-(13,13,13-2H3)Galanthamine

  • Molecular FormulaC17H18D3NO3
  • Average mass290.372 Da
  • Monoisotopic mass290.170959 Da
  • ChemSpider ID48061118

  • defined stereocentres - 2 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3α)-(13,13,13-2H3)Galanthamin [German] [ACD/IUPAC Name]
(3α)-(13,13,13-2H3)Galanthamine [ACD/IUPAC Name]
(3α)-(13,13,13-2H3)Galanthamine [French] [ACD/IUPAC Name]
6H-Benzofuro[3a,3,2-ef][2]benzazepin-6-ol, 4a,5,9,10,11,12-hexahydro-11-methyl-3-(methyl-d3-oxy)-, (4aS,6S,8aS)- [ACD/Index Name]
1217655-71-4 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 439.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 73.4±3.0 kJ/mol
    Flash Point: 219.5±28.7 °C
    Index of Refraction: 1.636
    Molar Refractivity: 80.3±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.75
    ACD/LogD (pH 5.5): -0.79
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.92
    ACD/BCF (pH 7.4): 2.07
    ACD/KOC (pH 7.4): 38.69
    Polar Surface Area: 42 Å2
    Polarizability: 31.8±0.5 10-24cm3
    Surface Tension: 56.6±5.0 dyne/cm
    Molar Volume: 223.9±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement