ChemSpider 2D Image | (3-Isopropyl-1,2,4-oxadiazol-5-yl)methanamine | C6H11N3O

(3-Isopropyl-1,2,4-oxadiazol-5-yl)methanamine

  • Molecular FormulaC6H11N3O
  • Average mass141.171 Da
  • Monoisotopic mass141.090210 Da
  • ChemSpider ID21927693

More details:

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

(3-Isopropyl-1,2,4-oxadiazol-5-yl)methanamine
1-(3-Isopropyl-1,2,4-oxadiazol-5-yl)methanamin [German] [ACD/IUPAC Name]
1-(3-Isopropyl-1,2,4-oxadiazol-5-yl)methanamine [ACD/IUPAC Name]
1-(3-Isopropyl-1,2,4-oxadiazol-5-yl)méthanamine [French] [ACD/IUPAC Name]
1,2,4-Oxadiazole-5-methanamine, 3-(1-methylethyl)- [ACD/Index Name]
3-(1-Methylethyl)-1,2,4-oxadiazole-5-methanamine
936940-67-9 [RN]
(3-isopropyl-1,2,4-oxadiazol-5-yl)methylamine
(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methanamine
[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methanamine
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 236.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 47.3±3.0 kJ/mol
    Flash Point: 96.9±27.9 °C
    Index of Refraction: 1.492
    Molar Refractivity: 37.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.09
    ACD/LogD (pH 5.5): -1.08
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 2.50
    ACD/LogD (pH 7.4): -0.25
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 16.73
    Polar Surface Area: 65 Å2
    Polarizability: 14.8±0.5 10-24cm3
    Surface Tension: 43.4±3.0 dyne/cm
    Molar Volume: 128.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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