ChemSpider 2D Image | (4R,5R)-5-(Carboxymethyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid | C6H7NO6

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

  • Molecular FormulaC6H7NO6
  • Average mass189.123 Da
  • Monoisotopic mass189.027344 Da
  • ChemSpider ID61686233

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5R)-5-(Carboxymethyl)-2-oxo-1,3-oxazolidin-4-carbonsäure [German] [ACD/IUPAC Name]
(4R,5R)-5-(Carboxymethyl)-2-oxo-1,3-oxazolidine-4-carboxylic acid [ACD/IUPAC Name]
5-Oxazolidineacetic acid, 4-carboxy-2-oxo-, (4R,5R)- [ACD/Index Name]
Acide (4R,5R)-5-(carboxyméthyl)-2-oxo-1,3-oxazolidine-4-carboxylique [French] [ACD/IUPAC Name]
50706-20-2 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 710.4±53.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 113.2±6.0 kJ/mol
Flash Point: 383.5±30.9 °C
Index of Refraction: 1.528
Molar Refractivity: 35.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): -4.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 113 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 67.6±3.0 dyne/cm
Molar Volume: 116.7±3.0 cm3

Click to predict properties on the Chemicalize site


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