ChemSpider 2D Image | (2R,3S,4S)-1-[(2S,3S,4R,5R,6S)-2,3,4,5,6,7-Hexahydroxyheptyl]-3,4-dihydroxy-2-(hydroxymethyl)tetrahydrothiophenium | C12H25O9S

(2R,3S,4S)-1-[(2S,3S,4R,5R,6S)-2,3,4,5,6,7-Hexahydroxyheptyl]-3,4-dihydroxy-2-(hydroxymethyl)tetrahydrothiophenium

  • Molecular FormulaC12H25O9S
  • Average mass345.386 Da
  • Monoisotopic mass345.121368 Da
  • ChemSpider ID26326683

  • Charge - Charge

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2R,3S,4S)-1-[(2S,3S,4R,5R,6S)-2,3,4,5,6,7-Hexahydroxyheptyl]-3,4-dihydroxy-2-(hydroxymethyl)tetrahydrothiophenium [ACD/IUPAC Name]
(2R,3S,4S)-1-[(2S,3S,4R,5R,6S)-2,3,4,5,6,7-Hexahydroxyheptyl]-3,4-dihydroxy-2-(hydroxymethyl)tetrahydrothiophenium [German] [ACD/IUPAC Name]
(2R,3S,4S)-1-[(2S,3S,4R,5R,6S)-2,3,4,5,6,7-Hexahydroxyheptyl]-3,4-dihydroxy-2-(hydroxyméthyl)tétrahydrothiophénium [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 182 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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