ChemSpider 2D Image | 5-Thio-L-idose | C6H12O5S

5-Thio-L-idose

  • Molecular FormulaC6H12O5S
  • Average mass196.221 Da
  • Monoisotopic mass196.040543 Da
  • ChemSpider ID32741445
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

5-Thio-L-idose [ACD/IUPAC Name]
5-Thio-L-idose [French] [ACD/IUPAC Name]
L-Idose, 5-thio- [ACD/Index Name]
20408-97-3 [RN]
5-Thio-D-glucose [ACD/IUPAC Name]
70337-35-8 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 463.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.5±6.0 kJ/mol
Flash Point: 234.0±28.7 °C
Index of Refraction: 1.588
Molar Refractivity: 43.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.93
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.63
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.57
Polar Surface Area: 137 Å2
Polarizability: 17.4±0.5 10-24cm3
Surface Tension: 78.3±3.0 dyne/cm
Molar Volume: 130.5±3.0 cm3

Click to predict properties on the Chemicalize site






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