ChemSpider 2D Image | Carvedilol-d5 | C24H21D5N2O4

Carvedilol-d5

  • Molecular FormulaC24H21D5N2O4
  • Average mass411.505 Da
  • Monoisotopic mass411.220642 Da
  • ChemSpider ID23992865
  • Non-standard isotope - Non-standard isotope


More details:






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

1-(9H-Carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}-2-(2H5)propanol [ACD/IUPAC Name]
1-(9H-Carbazol-4-yloxy)-3-{[2-(2-methoxyphenoxy)ethyl]amino}-2-(2H5)propanol [German] [ACD/IUPAC Name]
1-(9H-Carbazol-4-yloxy)-3-{[2-(2-méthoxyphénoxy)éthyl]amino}-2-(2H5)propanol [French] [ACD/IUPAC Name]
2-Propan-1,1,2,3,3-d5-ol, 1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]- [ACD/Index Name]
929106-58-1 [RN]
Carvedilol-d5
(??)-Carvedilol-d5
1-(9H-carbazol-4-yloxy)-1,1,2,3,3-pentadeuterio-3-[2-(2-methoxyphenoxy)ethylamino]propan-2-ol
1-(9H-carbazol-4-yloxy)-3-[[2-(2-methoxyphenoxy)ethyl]amino]-2-propan-1,1,2,3,3-d5-ol
1-[(9H-Carbazol-4-yl)oxy]-3-{[2-(2-methoxyphenoxy)ethyl]amino}(2H5)propan-2-ol
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.3±0.1 g/cm3
    Boiling Point: 655.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.4±3.0 kJ/mol
    Flash Point: 350.1±31.5 °C
    Index of Refraction: 1.657
    Molar Refractivity: 119.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 0
    ACD/LogP: 4.11
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 1.51
    ACD/KOC (pH 5.5): 8.15
    ACD/LogD (pH 7.4): 3.04
    ACD/BCF (pH 7.4): 68.73
    ACD/KOC (pH 7.4): 369.65
    Polar Surface Area: 76 Å2
    Polarizability: 47.4±0.5 10-24cm3
    Surface Tension: 53.9±3.0 dyne/cm
    Molar Volume: 325.1±3.0 cm3

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