ChemSpider 2D Image | 3-Hydroxy-3-{[(2-methyl-2-propanyl)oxy]carbonyl}pentanedioic acid | C10H16O7

3-Hydroxy-3-{[(2-methyl-2-propanyl)oxy]carbonyl}pentanedioic acid

  • Molecular FormulaC10H16O7
  • Average mass248.230 Da
  • Monoisotopic mass248.089600 Da
  • ChemSpider ID48057755

More details:

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

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, 2-(1,1-dimethylethyl) ester [ACD/Index Name]
3-Hydroxy-3-{[(2-methyl-2-propanyl)oxy]carbonyl}pentandisäure [German] [ACD/IUPAC Name]
3-Hydroxy-3-{[(2-methyl-2-propanyl)oxy]carbonyl}pentanedioic acid [ACD/IUPAC Name]
Acide 3-hydroxy-3-{[(2-méthyl-2-propanyl)oxy]carbonyl}pentanedioïque [French] [ACD/IUPAC Name]
114340-52-2 [RN]
3-(tert-Butoxycarbonyl)-3-hydroxypentanedioic acid
3-(tert-butoxycarbonyl)-3-hydroxypentanedioic acid(wxc02558)
3-[(TERT-BUTOXY)CARBONYL]-3-HYDROXYPENTANEDIOIC ACID
3-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonyl]pentanedioic acid
3-tert-butoxycarbonyl-3-hydroxy-pentanedioic acid
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 432.5±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 79.5±6.0 kJ/mol
    Flash Point: 166.7±22.2 °C
    Index of Refraction: 1.507
    Molar Refractivity: 54.7±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: -0.68
    ACD/LogD (pH 5.5): -3.41
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.76
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 121 Å2
    Polarizability: 21.7±0.5 10-24cm3
    Surface Tension: 56.9±3.0 dyne/cm
    Molar Volume: 183.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement