ChemSpider 2D Image | (4R,5S)-5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid | C5H7NO4

(4R,5S)-5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid

  • Molecular FormulaC5H7NO4
  • Average mass145.113 Da
  • Monoisotopic mass145.037506 Da
  • ChemSpider ID24191274

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5S)-5-Methyl-2-oxo-1,3-oxazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
(4R,5S)-5-Methyl-2-oxo-1,3-oxazolidine-4-carboxylic acid [ACD/IUPAC Name]
4-Oxazolidinecarboxylic acid, 5-methyl-2-oxo-, (4R,5S)- [ACD/Index Name]
Acide (4R,5S)-5-méthyl-2-oxo-1,3-oxazolidine-4-carboxylique [French] [ACD/IUPAC Name]
(4R,5S)-5-methyl-2-oxooxazolidine-4-carboxylic acid
122871-70-9 [RN]
37791-36-9 [RN]
4-Oxazolidinecarboxylic acid, 5-methyl-2-oxo-, (4R-trans)- (9CI)
4-Oxazolidinecarboxylicacid,5-methyl-2-oxo-,(4R-trans)-(9CI)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 495.3±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 83.5±6.0 kJ/mol
Flash Point: 253.4±25.7 °C
Index of Refraction: 1.481
Molar Refractivity: 29.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.29
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): -3.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 104.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement