ChemSpider 2D Image | Methyl 5-oxo-4,5-dihydroisoxazole-3-carboxylate | C5H5NO4

Methyl 5-oxo-4,5-dihydroisoxazole-3-carboxylate

  • Molecular FormulaC5H5NO4
  • Average mass143.098 Da
  • Monoisotopic mass143.021851 Da
  • ChemSpider ID30647873

More details:

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

3-Isoxazolecarboxylic acid, 4,5-dihydro-5-oxo-, methyl ester [ACD/Index Name]
5-Oxo-4,5-dihydro-1,2-oxazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
882530-43-0 [RN]
Methyl 5-oxo-4,5-dihydro-1,2-oxazole-3-carboxylate [ACD/IUPAC Name]
Methyl 5-oxo-4,5-dihydroisoxazole-3-carboxylate
Methyl-5-oxo-4,5-dihydro-1,2-oxazol-3-carboxylat [German] [ACD/IUPAC Name]
2-Aminoadamantane-2-carboxylic acid
MFCD27923181

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

Density: 1.5±0.1 g/cm3
Boiling Point: 186.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.3±3.0 kJ/mol
Flash Point: 84.1±17.1 °C
Index of Refraction: 1.547
Molar Refractivity: 30.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.68
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.54
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.54
Polar Surface Area: 65 Å2
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 49.9±7.0 dyne/cm
Molar Volume: 95.7±7.0 cm3

Click to predict properties on the Chemicalize site


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