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Search term: UULNBDNUSXGHBK (Found by InChIKey (skeleton match))

ChemSpider 2D Image | THIOSOPHOROSE | C12H22O10S

THIOSOPHOROSE

  • Molecular FormulaC12H22O10S
  • Average mass358.362 Da
  • Monoisotopic mass358.093353 Da
  • ChemSpider ID57267290
  • defined stereocentres - 9 of 10 defined stereocentres


More details:






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

2-O-β-D-Glucopyranosyl-1-thio-D-glucopyranose [German] [ACD/IUPAC Name]
2-O-β-D-Glucopyranosyl-1-thio-D-glucopyranose [ACD/IUPAC Name]
2-O-β-D-Glucopyranosyl-1-thio-D-glucopyranose [French] [ACD/IUPAC Name]
92051-25-7 [RN]
D-Glucopyranose, 2-O-β-D-glucopyranosyl-1-thio- [ACD/Index Name]
THIOSOPHOROSE

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

Density: 1.7±0.1 g/cm3
Boiling Point: 683.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.6±6.0 kJ/mol
Flash Point: 367.0±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 77.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -2.51
ACD/LogD (pH 5.5): -2.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.22
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.19
Polar Surface Area: 208 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 99.3±5.0 dyne/cm
Molar Volume: 210.4±5.0 cm3

Click to predict properties on the Chemicalize site






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