ChemSpider 2D Image | 3-(4-Methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole-5-butanoic acid | C9H10N4O4

3-(4-Methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole-5-butanoic acid

  • Molecular FormulaC9H10N4O4
  • Average mass238.200 Da
  • Monoisotopic mass238.070206 Da
  • ChemSpider ID21475757

More details:

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

1,2,4-Oxadiazole-5-butanoic acid, 3-(4-methyl-1,2,5-oxadiazol-3-yl)- [ACD/Index Name]
3-(4-Methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazole-5-butanoic acid
4-[3-(4-Methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]butanoic acid [ACD/IUPAC Name]
4-[3-(4-Methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]butansäure [German] [ACD/IUPAC Name]
924871-26-1 [RN]
Acide 4-[3-(4-méthyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl]butanoïque [French] [ACD/IUPAC Name]
4-(3-(4-methyl-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-yl)butanoic acid
4-[3-(4-Methyl-furazan-3-yl)-[1,2,4]oxadiazol-5-yl]-butyric acid
MFCD08848268

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 486.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.3±3.0 kJ/mol
    Flash Point: 248.3±31.5 °C
    Index of Refraction: 1.536
    Molar Refractivity: 53.0±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.93
    ACD/LogD (pH 5.5): 0.11
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 9.31
    ACD/LogD (pH 7.4): -1.70
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 115 Å2
    Polarizability: 21.0±0.5 10-24cm3
    Surface Tension: 64.1±3.0 dyne/cm
    Molar Volume: 169.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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