ChemSpider 2D Image | MFCD01074226 | C10H2D5NO3

MFCD01074226

  • Molecular FormulaC10H2D5NO3
  • Average mass194.198 Da
  • Monoisotopic mass194.073975 Da
  • ChemSpider ID24532678

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Quinoline-3,5,6,7,8-d5-carboxylic acid, 4-hydroxy- [ACD/Index Name]
350820-13-2 [RN]
4-Hydroxy(2H5)quinoline-2-carboxylic acid
4-Hydroxy-2-(2H5)chinolincarbonsäure [German] [ACD/IUPAC Name]
4-Hydroxy-2-(2H5)quinolinecarboxylic acid [ACD/IUPAC Name]
Acide 4-hydroxy-2-(2H5)quinoléinecarboxylique [French] [ACD/IUPAC Name]
Kynurenic acid-3,5,6,7,8-d5
Kynurenic-3,5,6,7,8-d5 Acid
MFCD01074226
3,5,6,7,8-pentadeuterio-4-oxo-1H-quinoline-2-carboxylic acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 431.7±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.5±3.0 kJ/mol
    Flash Point: 214.9±25.9 °C
    Index of Refraction: 1.730
    Molar Refractivity: 51.0±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.88
    ACD/LogD (pH 5.5): -1.07
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.23
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 70 Å2
    Polarizability: 20.2±0.5 10-24cm3
    Surface Tension: 80.3±3.0 dyne/cm
    Molar Volume: 127.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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