ChemSpider 2D Image | 3-Thiomorpholinecarboxylic acid 1,1-dioxide | C5H9NO4S

3-Thiomorpholinecarboxylic acid 1,1-dioxide

  • Molecular FormulaC5H9NO4S
  • Average mass179.194 Da
  • Monoisotopic mass179.025223 Da
  • ChemSpider ID32038786

More details:






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

3-Thiomorpholincarbonsäure-1,1-dioxid [German] [ACD/IUPAC Name]
3-Thiomorpholinecarboxylic acid 1,1-dioxide [ACD/IUPAC Name]
3-Thiomorpholinecarboxylic acid, 1,1-dioxide [ACD/Index Name]
Acide 1,1-dioxyde de -3-thiomorpholinecarboxylique [French] [ACD/IUPAC Name]
1,1-dioxo-1??-thiomorpholine-3-carboxylic acid
1,1-dioxo-1λ6,4-thiomorpholine-3-carboxylic acid
1,1-dioxo-1λ6-thiomorpholine-3-carboxylic acid
1461868-90-5 [RN]
MFCD21129258

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

Density: 1.5±0.1 g/cm3
Boiling Point: 504.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 84.7±6.0 kJ/mol
Flash Point: 258.8±30.1 °C
Index of Refraction: 1.526
Molar Refractivity: 37.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.57
ACD/LogD (pH 5.5): -3.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.74
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 92 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 121.3±3.0 cm3

Click to predict properties on the Chemicalize site






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