ChemSpider 2D Image | 3-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-oxo-1,3-oxazolidine-5-carboxylic acid | C8H11NO6S

3-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-oxo-1,3-oxazolidine-5-carboxylic acid

  • Molecular FormulaC8H11NO6S
  • Average mass249.241 Da
  • Monoisotopic mass249.030701 Da
  • ChemSpider ID37792597

More details:






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

3-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-oxo-1,3-oxazolidin-5-carbonsäure [German] [ACD/IUPAC Name]
3-(1,1-Dioxidotetrahydro-3-thiophenyl)-2-oxo-1,3-oxazolidine-5-carboxylic acid [ACD/IUPAC Name]
5-Oxazolidinecarboxylic acid, 2-oxo-3-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]
Acide 3-(1,1-dioxydotétrahydro-3-thiophényl)-2-oxo-1,3-oxazolidine-5-carboxylique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 700.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 111.7±6.0 kJ/mol
Flash Point: 377.3±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 51.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.96
ACD/LogD (pH 5.5): -4.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 109 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 77.7±3.0 dyne/cm
Molar Volume: 148.5±3.0 cm3

Click to predict properties on the Chemicalize site






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