ChemSpider 2D Image | MFCD03428215 | C11H13D5N2O3

MFCD03428215

  • Molecular FormulaC11H13D5N2O3
  • Average mass231.303 Da
  • Monoisotopic mass231.163132 Da
  • ChemSpider ID23935294

  • Non-standard isotope - Non-standard isotope

More details:

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

1190003-63-4 [RN]
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(ethyl-d5)-5-(3-methylbutyl)- [ACD/Index Name]
200-659-6 [EINECS]
5-(2H5)Ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione [ACD/IUPAC Name]
5-(2H5)Éthyl-5-(3-méthylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione [French] [ACD/IUPAC Name]
5-(2H5)Ethyl-5-(3-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidintrion [German] [ACD/IUPAC Name]
5-(2H5)Ethyl-5-(3-methylbutyl)pyrimidine-2,4,6(1H,3H,5H)-trione
MFCD03428215
5-(3-methylbutyl)-5-(1,1,2,2,2-pentadeuterioethyl)-1,3-diazinane-2,4,6-trione
5-ethyl-5-(3-methylbutyl)barbituric acid
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.460
    Molar Refractivity: 58.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.05
    ACD/LogD (pH 5.5): 2.04
    ACD/BCF (pH 5.5): 20.97
    ACD/KOC (pH 5.5): 306.98
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 16.21
    ACD/KOC (pH 7.4): 237.32
    Polar Surface Area: 75 Å2
    Polarizability: 23.0±0.5 10-24cm3
    Surface Tension: 33.1±3.0 dyne/cm
    Molar Volume: 211.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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