ChemSpider 2D Image | 4-O-beta-L-Glucopyranosyl-L-gluconic acid | C12H22O12

4-O-β-L-Glucopyranosyl-L-gluconic acid

  • Molecular FormulaC12H22O12
  • Average mass358.296 Da
  • Monoisotopic mass358.111115 Da
  • ChemSpider ID111309720

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

4-O-β-L-Glucopyranosyl-L-gluconic acid [ACD/IUPAC Name]
4-O-β-L-Glucopyranosyl-L-gluconsäure [German] [ACD/IUPAC Name]
Acide 4-O-β-L-glucopyranosyl-L-gluconique [French] [ACD/IUPAC Name]
L-Gluconic acid, 4-O-β-L-glucopyranosyl- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 864.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.8±6.0 kJ/mol
Flash Point: 319.1±27.8 °C
Index of Refraction: 1.648
Molar Refractivity: 72.8±0.4 cm3
#H bond acceptors: 12
#H bond donors: 9
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -4.06
ACD/LogD (pH 5.5): -6.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 218 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 119.9±5.0 dyne/cm
Molar Volume: 200.0±5.0 cm3

Click to predict properties on the Chemicalize site


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