ChemSpider 2D Image | 3-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1,3-oxazolidine-4-carboxylic acid | C9H13NO6

3-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1,3-oxazolidine-4-carboxylic acid

  • Molecular FormulaC9H13NO6
  • Average mass231.203 Da
  • Monoisotopic mass231.074280 Da
  • ChemSpider ID60644191

More details:

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

3,4-Oxazolidinedicarboxylic acid, 2-oxo-, 3-(1,1-dimethylethyl) ester [ACD/Index Name]
3-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1,3-oxazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
3-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-oxo-1,3-oxazolidine-4-carboxylic acid [ACD/IUPAC Name]
Acide 3-{[(2-méthyl-2-propanyl)oxy]carbonyl}-2-oxo-1,3-oxazolidine-4-carboxylique [French] [ACD/IUPAC Name]
113525-84-1 [RN]
MFCD24472313

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

Density: 1.4±0.1 g/cm3
Boiling Point: 344.1±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.6±6.0 kJ/mol
Flash Point: 161.9±30.7 °C
Index of Refraction: 1.512
Molar Refractivity: 50.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.40
ACD/LogD (pH 5.5): -2.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 166.7±3.0 cm3

Click to predict properties on the Chemicalize site


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