ChemSpider 2D Image | Octyl 4-O-beta-D-glucopyranosyl-1-thio-beta-D-glucopyranoside | C20H38O10S

Octyl 4-O-β-D-glucopyranosyl-1-thio-β-D-glucopyranoside

  • Molecular FormulaC20H38O10S
  • Average mass470.575 Da
  • Monoisotopic mass470.218567 Da
  • ChemSpider ID32696768

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

4-O-β-D-Glucopyranosyl-1-thio-β-D-glucopyranoside d'octyle [French] [ACD/IUPAC Name]
Octyl 4-O-β-D-glucopyranosyl-1-thio-β-D-glucopyranoside [ACD/IUPAC Name]
Octyl-4-O-β-D-glucopyranosyl-1-thio-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside, octyl 4-O-β-D-glucopyranosyl-1-thio- [ACD/Index Name]
148616-91-5 [RN]
MFCD09750647 [MDL number]
Octyl 4-O-?-D-glucopyranosyl-1-thio-?-D-glucopyranoside
Octyl b-D-thiomaltopyranoside

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 706.4±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±5.1 mmHg at 25°C
    Enthalpy of Vaporization: 118.1±6.0 kJ/mol
    Flash Point: 381.0±32.9 °C
    Index of Refraction: 1.589
    Molar Refractivity: 114.3±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 7
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 2
    ACD/LogP: 1.15
    ACD/LogD (pH 5.5): 0.68
    ACD/BCF (pH 5.5): 1.93
    ACD/KOC (pH 5.5): 55.67
    ACD/LogD (pH 7.4): 0.68
    ACD/BCF (pH 7.4): 1.93
    ACD/KOC (pH 7.4): 55.67
    Polar Surface Area: 195 Å2
    Polarizability: 45.3±0.5 10-24cm3
    Surface Tension: 70.7±5.0 dyne/cm
    Molar Volume: 339.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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