ChemSpider 2D Image | 1-[3-(1-Ethoxyethyl)-1,2,4-oxadiazol-5-yl]methanamine | C7H13N3O2

1-[3-(1-Ethoxyethyl)-1,2,4-oxadiazol-5-yl]methanamine

  • Molecular FormulaC7H13N3O2
  • Average mass171.197 Da
  • Monoisotopic mass171.100784 Da
  • ChemSpider ID28545858

More details:

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

1,2,4-Oxadiazole-5-methanamine, 3-(1-ethoxyethyl)- [ACD/Index Name]
1-[3-(1-Ethoxyethyl)-1,2,4-oxadiazol-5-yl]methanamin [German] [ACD/IUPAC Name]
1-[3-(1-Ethoxyethyl)-1,2,4-oxadiazol-5-yl]methanamine [ACD/IUPAC Name]
1-[3-(1-Éthoxyéthyl)-1,2,4-oxadiazol-5-yl]méthanamine [French] [ACD/IUPAC Name]
[3-(1-ethoxyethyl)-1,2,4-oxadiazol-5-yl]methanamine
1339660-12-6 [RN]
AGN-PC-0AA0MH
AKOS013865051
EN300-91858
MCULE-1343590747
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 265.7±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 50.4±3.0 kJ/mol
    Flash Point: 114.5±30.1 °C
    Index of Refraction: 1.489
    Molar Refractivity: 43.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.25
    ACD/LogD (pH 5.5): -1.16
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.20
    ACD/LogD (pH 7.4): -0.31
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 15.63
    Polar Surface Area: 74 Å2
    Polarizability: 17.3±0.5 10-24cm3
    Surface Tension: 43.7±3.0 dyne/cm
    Molar Volume: 151.6±3.0 cm3

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