ChemSpider 2D Image | Penta-O-acetyl-a-L-Idopyranose | C16H22O11

Penta-O-acetyl-a-L-Idopyranose

  • Molecular FormulaC16H22O11
  • Average mass390.339 Da
  • Monoisotopic mass390.116211 Da
  • ChemSpider ID18603233
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

1,2,3,4,6-Penta-O-acetyl-α-L-idopyranose [ACD/IUPAC Name]
1,2,3,4,6-Penta-O-acetyl-α-L-idopyranose [German] [ACD/IUPAC Name]
1,2,3,4,6-Penta-O-acétyl-α-L-idopyranose [French] [ACD/IUPAC Name]
16299-15-3 [RN]
Penta-O-acetyl-a-L-Idopyranose
α-L-Idopyranose, pentaacetate [ACD/Index Name]
[16299-15-3] [RN]
2152-77-4 [RN]
A-L-IDOPYRANOSE, PENTAACETATE
MFCD03453193 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 434.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 69.1±3.0 kJ/mol
    Flash Point: 188.1±28.8 °C
    Index of Refraction: 1.482
    Molar Refractivity: 85.0±0.4 cm3
    #H bond acceptors: 11
    #H bond donors: 0
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 1
    ACD/LogP: 1.68
    ACD/LogD (pH 5.5): 1.02
    ACD/BCF (pH 5.5): 3.54
    ACD/KOC (pH 5.5): 85.97
    ACD/LogD (pH 7.4): 1.02
    ACD/BCF (pH 7.4): 3.54
    ACD/KOC (pH 7.4): 85.97
    Polar Surface Area: 141 Å2
    Polarizability: 33.7±0.5 10-24cm3
    Surface Tension: 46.7±5.0 dyne/cm
    Molar Volume: 298.0±5.0 cm3

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