ChemSpider 2D Image | 5,6-dihydroxy-2-(propan-2-yl)pyrimidine-4-carboxamide | C8H11N3O3

5,6-dihydroxy-2-(propan-2-yl)pyrimidine-4-carboxamide

  • Molecular FormulaC8H11N3O3
  • Average mass197.191 Da
  • Monoisotopic mass197.080048 Da
  • ChemSpider ID28599865

More details:

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

1,6-Dihydro-5-hydroxy-2-(1-methylethyl)-6-oxo-4-pyrimidinecarboxamide
5,6-dihydroxy-2-(propan-2-yl)pyrimidine-4-carboxamide
954241-13-5 [RN]
[954241-13-5] [RN]
4-Pyrimidinecarboxamide, 5,6-dihydroxy-2-(1-methylethyl)- [ACD/Index Name]
5,6-Dihydroxy-2-isopropyl-4-pyrimidincarboxamid [German] [ACD/IUPAC Name]
5,6-Dihydroxy-2-isopropyl-4-pyrimidinecarboxamide [ACD/IUPAC Name]
5,6-Dihydroxy-2-isopropyl-4-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
5,6-Dihydroxy-2-isopropylpyrimidine-4-carboxamide
5,6-Dihydroxy-2-isopropyl-pyrimidine-4-carboxylic acid amide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 357.0±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.6±3.0 kJ/mol
    Flash Point: 169.7±27.9 °C
    Index of Refraction: 1.614
    Molar Refractivity: 49.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 4
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 1.93
    ACD/LogD (pH 5.5): 0.03
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 10.48
    ACD/LogD (pH 7.4): -1.68
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 109 Å2
    Polarizability: 19.5±0.5 10-24cm3
    Surface Tension: 74.0±3.0 dyne/cm
    Molar Volume: 141.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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