ChemSpider 2D Image | 3-(2-Methyl-3-oxo-2-butanyl)pentanedioic acid | C10H16O5

3-(2-Methyl-3-oxo-2-butanyl)pentanedioic acid

  • Molecular FormulaC10H16O5
  • Average mass216.231 Da
  • Monoisotopic mass216.099777 Da
  • ChemSpider ID59696650

More details:

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

3-(2-Methyl-3-oxo-2-butanyl)pentandisäure [German] [ACD/IUPAC Name]
3-(2-Methyl-3-oxo-2-butanyl)pentanedioic acid [ACD/IUPAC Name]
Acide 3-(2-méthyl-3-oxo-2-butanyl)pentanedioïque [French] [ACD/IUPAC Name]
Pentanedioic acid, 3-(1,1-dimethyl-2-oxopropyl)- [ACD/Index Name]
3-(2-methyl-3-oxobutan-2-yl)pentanedioic acid
Isoketocamphoric acid

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

Density: 1.2±0.1 g/cm3
Boiling Point: 401.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.7±6.0 kJ/mol
Flash Point: 211.0±19.7 °C
Index of Refraction: 1.482
Molar Refractivity: 51.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.38
ACD/LogD (pH 5.5): -2.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 180.4±3.0 cm3

Click to predict properties on the Chemicalize site


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