ChemSpider 2D Image | 3-[1-(1,3-Benzodioxol-5-ylmethyl)-2,5-dioxo-4-imidazolidinyl]propanoic acid | C14H14N2O6

3-[1-(1,3-Benzodioxol-5-ylmethyl)-2,5-dioxo-4-imidazolidinyl]propanoic acid

  • Molecular FormulaC14H14N2O6
  • Average mass306.271 Da
  • Monoisotopic mass306.085175 Da
  • ChemSpider ID30665330

More details:

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

3-[1-(1,3-Benzodioxol-5-ylmethyl)-2,5-dioxo-4-imidazolidinyl]propanoic acid [ACD/IUPAC Name]
3-[1-(1,3-Benzodioxol-5-ylmethyl)-2,5-dioxo-4-imidazolidinyl]propansäure [German] [ACD/IUPAC Name]
4-Imidazolidinepropanoic acid, 1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxo- [ACD/Index Name]
Acide 3-[1-(1,3-benzodioxol-5-ylméthyl)-2,5-dioxo-4-imidazolidinyl]propanoïque [French] [ACD/IUPAC Name]
1214144-69-0 [RN]
3-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]propanoic acid
3-[1-(2H-1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]propanoic acid
3-{1-[(1,3-dioxaindan-5-yl)methyl]-2,5-dioxoimidazolidin-4-yl}propanoic acid
3-{1-[(2H-1,3-benzodioxol-5-yl)methyl]-2,5-dioxoimidazolidin-4-yl}propanoic acid
MFCD28142967
More...

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 560.5±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 88.7±3.0 kJ/mol
    Flash Point: 292.8±30.7 °C
    Index of Refraction: 1.689
    Molar Refractivity: 72.6±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 0.29
    ACD/LogD (pH 5.5): -0.65
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.28
    ACD/LogD (pH 7.4): -2.48
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 109 Å2
    Polarizability: 28.8±0.5 10-24cm3
    Surface Tension: 67.8±7.0 dyne/cm
    Molar Volume: 190.1±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement