ChemSpider 2D Image | L-(2,3,3-~2~H_3_)Asparagine | C4H5D3N2O3

L-(2,3,3-2H3)Asparagine

  • Molecular FormulaC4H5D3N2O3
  • Average mass135.136 Da
  • Monoisotopic mass135.072327 Da
  • ChemSpider ID48058684

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

L-(2,3,3-2H3)Asparagin [German] [ACD/IUPAC Name]
L-(2,3,3-2H3)Asparagine [ACD/IUPAC Name]
L-(2,3,3-2H3)Asparagine [French] [ACD/IUPAC Name]
L-Asparagine-2,3,3-d3 [ACD/Index Name]
14341-77-6 [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: 438.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 76.2±6.0 kJ/mol
    Flash Point: 218.7±27.3 °C
    Index of Refraction: 1.533
    Molar Refractivity: 29.2±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 5
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 1
    ACD/LogP: -1.51
    ACD/LogD (pH 5.5): -3.93
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 106 Å2
    Polarizability: 11.6±0.5 10-24cm3
    Surface Tension: 71.7±3.0 dyne/cm
    Molar Volume: 94.0±3.0 cm3

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