ChemSpider 2D Image | 5-Methyl-1,3,4-oxadiazole-2-carboxylic acid | C4H4N2O3

5-Methyl-1,3,4-oxadiazole-2-carboxylic acid

  • Molecular FormulaC4H4N2O3
  • Average mass128.086 Da
  • Monoisotopic mass128.022186 Da
  • ChemSpider ID14440701

More details:

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

1,3,4-Oxadiazole-2-carboxylic acid, 5-methyl- [ACD/Index Name]
518048-06-1 [RN]
5-Methyl-[1,3,4]oxadiazole-2-carboxylic acid
5-Methyl-1,3,4-oxadiazol-2-carbonsäure [German] [ACD/IUPAC Name]
5-Methyl-1,3,4-oxadiazole-2-carboxylic acid [ACD/IUPAC Name]
Acide 5-méthyl-1,3,4-oxadiazole-2-carboxylique [French] [ACD/IUPAC Name]
[518048-06-1] [RN]
2-(9H-Carbazol-9-yl)phenylboronic Acid (contains varying amounts of Anhydride);2-(9H-Carbazol-9-yl)benzeneboronic Acid (contains varying amounts of Anhydride)
518048-81-2 [RN]
5-Methyl[1,3,4]oxadiazole-2-carboxylic acid
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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: 1.5±0.1 g/cm3
    Boiling Point: 317.9±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 59.1±3.0 kJ/mol
    Flash Point: 146.1±23.2 °C
    Index of Refraction: 1.518
    Molar Refractivity: 26.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -0.74
    ACD/LogD (pH 5.5): -3.05
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -3.21
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 76 Å2
    Polarizability: 10.5±0.5 10-24cm3
    Surface Tension: 66.0±3.0 dyne/cm
    Molar Volume: 87.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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