ChemSpider 2D Image | 2-Acetylbutyrolactone-3,3,4,4-d4 | C6H4D4O3

2-Acetylbutyrolactone-3,3,4,4-d4

  • Molecular FormulaC6H4D4O3
  • Average mass132.151 Da
  • Monoisotopic mass132.072449 Da
  • ChemSpider ID23935229

  • Non-standard isotope - Non-standard isotope

More details:

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

2(3H)-Furanone-4,5-d2, 3-acetyldihydro-d2- [ACD/Index Name]
2-Acetylbutyrolactone-3,3,4,4-d4
3-Acetyl(4,4,5,5-2H4)dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
3-Acetyl(4,4,5,5-2H4)dihydro-2(3H)-furanone [ACD/IUPAC Name]
3-Acétyl(4,4,5,5-2H4)dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
476646-93-2 [RN]
3-Acetyl(4,4,5,5-2H4)oxolan-2-one
3-acetyl-4,4,5,5-tetradeuteriooxolan-2-one

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 253.1±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.0±3.0 kJ/mol
    Flash Point: 128.2±25.4 °C
    Index of Refraction: 1.459
    Molar Refractivity: 29.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -1.27
    ACD/LogD (pH 5.5): -0.61
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 11.16
    ACD/LogD (pH 7.4): -0.61
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 11.16
    Polar Surface Area: 43 Å2
    Polarizability: 11.6±0.5 10-24cm3
    Surface Tension: 39.4±3.0 dyne/cm
    Molar Volume: 107.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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