ChemSpider 2D Image | alpha-D-Glucopyranosyl-(1->4)-4-thio-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-4-thio-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-4-thio-alpha-D-glucopyranose | C36H62O28S3

α-D-Glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranose

  • Molecular FormulaC36H62O28S3
  • Average mass1039.056 Da
  • Monoisotopic mass1038.258911 Da
  • ChemSpider ID396083

  • defined stereocentres - 30 of 30 defined stereocentres

More details:

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

α-D-Glucopyranose, O-α-D-glucopyranosyl-(1->4)-O-4-thio-α-D-glucopyranosyl-(1->4)-O-α-D-glucopyranosyl-(1->4)-O-4-thio-α-D-glucopyranosyl-(1->4)-O-α-D-glucopyranosyl-(1->4)-4-t hio- [ACD/Index Name]
α-D-Glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranose [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranose [German] [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-4-thio-α-D-glucopyranose [French] [ACD/IUPAC Name]
(R)-RETRO-THIORPHAN
THIO-MALTOHEXAOSE
TM6

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

RRT [DBID]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 1372.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 233.8±6.0 kJ/mol
Flash Point: 783.8±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 224.5±0.4 cm3
#H bond acceptors: 28
#H bond donors: 20
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -3.60
ACD/LogD (pH 5.5): -5.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 554 Å2
Polarizability: 89.0±0.5 10-24cm3
Surface Tension: 138.2±5.0 dyne/cm
Molar Volume: 552.6±5.0 cm3

Click to predict properties on the Chemicalize site


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