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ChemSpider 2D Image | 2-O-Sulfonato-alpha-D-glucopyranosyl alpha-D-glucopyranoside | C12H21O14S

2-O-Sulfonato-α-D-glucopyranosyl α-D-glucopyranoside

  • Molecular FormulaC12H21O14S
  • Average mass421.352 Da
  • Monoisotopic mass421.065735 Da
  • ChemSpider ID26331811
  • Charge - Charge

    defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-O-Sulfonato-α-D-glucopyranosyl α-D-glucopyranoside [ACD/IUPAC Name]
2-O-Sulfonato-α-D-glucopyranosyl-α-D-glucopyranosid [German] [ACD/IUPAC Name]
α-D-Glucopyranoside de 2-O-sulfonato-α-D-glucopyranosyle [French] [ACD/IUPAC Name]
α-D-Glucopyranoside, 2-O-sulfo-α-D-glucopyranosyl, ion(1-) [ACD/Index Name]
α,α-trehalose-2-sulfate anion
  • Miscellaneous
    • Chemical Class:

      The conjugate base of alpha,alpha-trehalose-2-sulfate arising from deprotonation of the sulfate group. ChEBI CHEBI:60091

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

Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -3.58
ACD/LogD (pH 5.5): -7.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 244 Å2
Surface Tension:
Molar Volume:

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