ChemSpider 2D Image | 3-{[(2-Methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide | C10H9N3O5

3-{[(2-Methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide

  • Molecular FormulaC10H9N3O5
  • Average mass251.196 Da
  • Monoisotopic mass251.054214 Da
  • ChemSpider ID23490987

More details:

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

1,2,4-Oxadiazole-5-carboxamide, 3-[[(2-methyl-4-oxo-4H-pyran-3-yl)oxy]methyl]- [ACD/Index Name]
3-{[(2-Methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazol-5-carboxamid [German] [ACD/IUPAC Name]
3-{[(2-Methyl-4-oxo-4H-pyran-3-yl)oxy]methyl}-1,2,4-oxadiazole-5-carboxamide [ACD/IUPAC Name]
3-{[(2-Méthyl-4-oxo-4H-pyran-3-yl)oxy]méthyl}-1,2,4-oxadiazole-5-carboxamide [French] [ACD/IUPAC Name]
1144461-37-9 [RN]
3-(2-Methyl-4-oxo-4H-pyran-3-yloxymethyl)-[1,2,4]oxadiazole-5-carboxylic acid amide
3-[(2-methyl-4-oxopyran-3-yl)oxymethyl]-1,2,4-oxadiazole-5-carboxamide
AGN-PC-05T0F6
AKOS005582380
c10h9n3o5
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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: 549.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 82.9±3.0 kJ/mol
    Flash Point: 286.0±32.9 °C
    Index of Refraction: 1.593
    Molar Refractivity: 56.5±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.69
    ACD/LogD (pH 5.5): -0.73
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 9.56
    ACD/LogD (pH 7.4): -0.73
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 9.56
    Polar Surface Area: 118 Å2
    Polarizability: 22.4±0.5 10-24cm3
    Surface Tension: 72.9±5.0 dyne/cm
    Molar Volume: 166.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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