ChemSpider 2D Image | alpha-D-Glucopyranosyl-(1->6)-6-thio-alpha-D-glucopyranosyl-(1->2)-D-glucose | C18H32O15S

α-D-Glucopyranosyl-(1->6)-6-thio-α-D-glucopyranosyl-(1->2)-D-glucose

  • Molecular FormulaC18H32O15S
  • Average mass520.503 Da
  • Monoisotopic mass520.146179 Da
  • ChemSpider ID2301527

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

D-Glucose, O-α-D-glucopyranosyl-(1->;6)-O-6-thio-α-D-glucopyranosyl-(1->;2)- [ACD/Index Name]
α-D-Glucopyranosyl-(1->6)-6-thio-α-D-glucopyranosyl-(1->2)-D-glucose [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->6)-6-thio-α-D-glucopyranosyl-(1->2)-D-glucose [German] [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->6)-6-thio-α-D-glucopyranosyl-(1->2)-D-glucose [French] [ACD/IUPAC Name]
143801-13-2 [RN]
6(2)-Thiopanose
6'-S-Glucopyranosyl-6'-thiomaltose

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

Density: 1.8±0.1 g/cm3
Boiling Point: 998.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 165.1±6.0 kJ/mol
Flash Point: 557.7±34.3 °C
Index of Refraction: 1.678
Molar Refractivity: 111.5±0.4 cm3
#H bond acceptors: 15
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -3.32
ACD/LogD (pH 5.5): -3.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 293 Å2
Polarizability: 44.2±0.5 10-24cm3
Surface Tension: 117.4±5.0 dyne/cm
Molar Volume: 295.6±5.0 cm3

Click to predict properties on the Chemicalize site


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