ChemSpider 2D Image | 1,3-Oxazol-5-ylacetonitrile | C5H4N2O

1,3-Oxazol-5-ylacetonitrile

  • Molecular FormulaC5H4N2O
  • Average mass108.098 Da
  • Monoisotopic mass108.032364 Da
  • ChemSpider ID21473382

More details:

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

1,3-Oxazol-5-ylacetonitril [German] [ACD/IUPAC Name]
1,3-Oxazol-5-ylacetonitrile [ACD/IUPAC Name]
1,3-Oxazol-5-ylacétonitrile [French] [ACD/IUPAC Name]
2-(1,3-oxazol-5-yl)acetonitrile
5-Oxazoleacetonitrile [ACD/Index Name]
947771-07-5 [RN]
2-(Oxazol-5-yl)acetonitrile
MFCD11101412 [MDL number]
Oxazole-5-acetonitrile

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 231.5±15.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 46.8±3.0 kJ/mol
    Flash Point: 93.8±20.4 °C
    Index of Refraction: 1.482
    Molar Refractivity: 26.1±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.65
    ACD/LogD (pH 5.5): -0.05
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 22.48
    ACD/LogD (pH 7.4): -0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 22.48
    Polar Surface Area: 50 Å2
    Polarizability: 10.3±0.5 10-24cm3
    Surface Tension: 47.2±3.0 dyne/cm
    Molar Volume: 91.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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