ChemSpider 2D Image | Maltotriitol | C18H34O16

Maltotriitol

  • Molecular FormulaC18H34O16
  • Average mass506.453 Da
  • Monoisotopic mass506.184692 Da
  • ChemSpider ID4450630

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

D-Glucitol, O-α-D-glucopyranosyl-(1->4)-O-α-D-glucopyranosyl-(1->4)- [ACD/Index Name]
Maltotriitol
α-D-Glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-D-glucitol [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-D-glucitol [German] [ACD/IUPAC Name]
α-D-Glucopyranosyl-(1->4)-α-D-glucopyranosyl-(1->4)-D-glucitol [French] [ACD/IUPAC Name]
(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxyhexane-1,2,3,5,6-pentol
?-D-Glc-(1?4 )-?-D-Glc-(1?4)-D-glucitol
[32860-62-1] [RN]
4)-O-?-D-glucopyranosyl-(1-->4)-D-glucitol
GLO-(4-1)GLC-(4-1)GLC
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

53T184B7B7 [DBID]
UNII:53T184B7B7 [DBID]

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 970.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 160.3±6.0 kJ/mol
    Flash Point: 540.7±34.3 °C
    Index of Refraction: 1.660
    Molar Refractivity: 106.4±0.4 cm3
    #H bond acceptors: 16
    #H bond donors: 12
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 3
    ACD/LogP: -5.20
    ACD/LogD (pH 5.5): -5.30
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.30
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 280 Å2
    Polarizability: 42.2±0.5 10-24cm3
    Surface Tension: 117.7±5.0 dyne/cm
    Molar Volume: 288.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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