ChemSpider 2D Image | 3-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]-N-ethyl-N-methylbenzamide | C13H14ClN3O2

3-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]-N-ethyl-N-methylbenzamide

  • Molecular FormulaC13H14ClN3O2
  • Average mass279.722 Da
  • Monoisotopic mass279.077454 Da
  • ChemSpider ID21800323

More details:

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

1119449-61-4 [RN]
3-[5-(Chlormethyl)-1,2,4-oxadiazol-3-yl]-N-ethyl-N-methylbenzamid [German] [ACD/IUPAC Name]
3-[5-(Chloromethyl)-1,2,4-oxadiazol-3-yl]-N-ethyl-N-methylbenzamide [ACD/IUPAC Name]
3-[5-(Chlorométhyl)-1,2,4-oxadiazol-3-yl]-N-éthyl-N-méthylbenzamide [French] [ACD/IUPAC Name]
Benzamide, 3-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-N-ethyl-N-methyl- [ACD/Index Name]
{3-[5-(chloromethyl)(1,2,4-oxadiazol-3-yl)]phenyl}-N-ethyl-N-methylcarboxamide
3-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)-N-ethyl-N-methylbenzamide

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

MFCD12026838 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 466.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 72.9±3.0 kJ/mol
    Flash Point: 236.1±31.5 °C
    Index of Refraction: 1.559
    Molar Refractivity: 72.1±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.53
    ACD/LogD (pH 5.5): 1.85
    ACD/BCF (pH 5.5): 14.93
    ACD/KOC (pH 5.5): 240.95
    ACD/LogD (pH 7.4): 1.85
    ACD/BCF (pH 7.4): 14.93
    ACD/KOC (pH 7.4): 240.95
    Polar Surface Area: 59 Å2
    Polarizability: 28.6±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 223.5±3.0 cm3

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