ChemSpider 2D Image | (2R)-2-Methyl-4-oxopentanedioic acid | C6H8O5

(2R)-2-Methyl-4-oxopentanedioic acid

  • Molecular FormulaC6H8O5
  • Average mass160.125 Da
  • Monoisotopic mass160.037170 Da
  • ChemSpider ID61327700

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Methyl-4-oxopentandisäure [German] [ACD/IUPAC Name]
(2R)-2-Methyl-4-oxopentanedioic acid [ACD/IUPAC Name]
Acide (2R)-2-méthyl-4-oxopentanedioïque [French] [ACD/IUPAC Name]
Pentanedioic acid, 2-methyl-4-oxo-, (2R)- [ACD/Index Name]
111768-22-0 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 335.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 63.6±6.0 kJ/mol
Flash Point: 171.1±19.7 °C
Index of Refraction: 1.488
Molar Refractivity: 33.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.09
ACD/LogD (pH 5.5): -4.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 13.1±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 114.3±3.0 cm3

Click to predict properties on the Chemicalize site


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