ChemSpider 2D Image | (1R,2R,3S,4R,5R)-5-[(1,3-Dihydroxy-2-propanyl)amino]-1-(hydroxymethyl)-1,2,3,4-cyclohexanetetrol | C10H21NO7

(1R,2R,3S,4R,5R)-5-[(1,3-Dihydroxy-2-propanyl)amino]-1-(hydroxymethyl)-1,2,3,4-cyclohexanetetrol

  • Molecular FormulaC10H21NO7
  • Average mass267.276 Da
  • Monoisotopic mass267.131805 Da
  • ChemSpider ID46755952

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1R,2R,3S,4R,5R)-5-[(1,3-Dihydroxy-2-propanyl)amino]-1-(hydroxymethyl)-1,2,3,4-cyclohexanetetrol [ACD/IUPAC Name]
(1R,2R,3S,4R,5R)-5-[(1,3-Dihydroxy-2-propanyl)amino]-1-(hydroxyméthyl)-1,2,3,4-cyclohexanetétrol [French] [ACD/IUPAC Name]
(1R,2R,3S,4R,5R)-5-[(1,3-Dihydroxy-2-propanyl)amino]-1-(hydroxymethyl)-1,2,3,4-cyclohexantetrol [German] [ACD/IUPAC Name]
1,2,3,4-Cyclohexanetetrol, 5-[[2-hydroxy-1-(hydroxymethyl)ethyl]amino]-1-(hydroxymethyl)-, (1R,2R,3S,4R,5R)- [ACD/Index Name]
(1R,2R,3S,4R,5R)-5-(1,3-dihydroxypropan-2-ylamino)-1-(hydroxymethyl)cyclohexane-1,2,3,4-tetrol
83480-29-9 [RN]
953807-25-5 [RN]
Voglibose [Wiki]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 601.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.9 mmHg at 25°C
    Enthalpy of Vaporization: 102.7±6.0 kJ/mol
    Flash Point: 274.1±22.1 °C
    Index of Refraction: 1.636
    Molar Refractivity: 60.6±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 8
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: -2.36
    ACD/LogD (pH 5.5): -4.49
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.97
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 154 Å2
    Polarizability: 24.0±0.5 10-24cm3
    Surface Tension: 99.7±5.0 dyne/cm
    Molar Volume: 169.1±5.0 cm3

    Click to predict properties on the Chemicalize site


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