ChemSpider 2D Image | Ethyl 5-methyl-1,3,4-oxadiazole-2-carboxylate | C6H8N2O3

Ethyl 5-methyl-1,3,4-oxadiazole-2-carboxylate

  • Molecular FormulaC6H8N2O3
  • Average mass156.139 Da
  • Monoisotopic mass156.053497 Da
  • ChemSpider ID22763846

More details:

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

1,3,4-Oxadiazole-2-carboxylic acid, 5-methyl-, ethyl ester [ACD/Index Name]
37641-36-4 [RN]
5-Méthyl-1,3,4-oxadiazole-2-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 5-methyl-1,3,4-oxadiazole-2-carboxylate [ACD/IUPAC Name]
Ethyl-5-methyl-1,3,4-oxadiazol-2-carboxylat [German] [ACD/IUPAC Name]
[37641-36-4] [RN]
1,​3,​4-​oxadiazole-​2-​carboxylic acid, 5-​methyl-​, ethyl ester
1,???3,???4-???oxadiazole-???2-???carboxylic acid, 5-???methyl-???, ethyl ester
5-Methyl[1,3,4]oxadiazole-2-carboxylic acid ethyl ester
5-Methyl-[1,3,4]oxadiazole-2-carboxylic acid ethyl ester
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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: 1.2±0.1 g/cm3
    Boiling Point: 238.0±23.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.5±3.0 kJ/mol
    Flash Point: 97.7±22.6 °C
    Index of Refraction: 1.468
    Molar Refractivity: 36.0±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): 0.73
    ACD/BCF (pH 5.5): 2.12
    ACD/KOC (pH 5.5): 59.65
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 2.12
    ACD/KOC (pH 7.4): 59.65
    Polar Surface Area: 65 Å2
    Polarizability: 14.3±0.5 10-24cm3
    Surface Tension: 43.3±3.0 dyne/cm
    Molar Volume: 129.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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