ChemSpider 2D Image | (1S)-1,5-Anhydro-1-(3-benzoyl-2,4,6-trihydroxyphenyl)-D-glucitol | C19H20O9

(1S)-1,5-Anhydro-1-(3-benzoyl-2,4,6-trihydroxyphenyl)-D-glucitol

  • Molecular FormulaC19H20O9
  • Average mass392.357 Da
  • Monoisotopic mass392.110718 Da
  • ChemSpider ID34529481

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-1-(3-benzoyl-2,4,6-trihydroxyphenyl)-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-(3-benzoyl-2,4,6-trihydroxyphenyl)-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-1-(3-benzoyl-2,4,6-trihydroxyphényl)-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-1-C-(3-benzoyl-2,4,6-trihydroxyphenyl)-, (1S)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 610.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 218.1±25.0 °C
Index of Refraction: 1.710
Molar Refractivity: 95.5±0.3 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 1.39
ACD/BCF (pH 5.5): 6.59
ACD/KOC (pH 5.5): 132.42
ACD/LogD (pH 7.4): 0.67
ACD/BCF (pH 7.4): 1.28
ACD/KOC (pH 7.4): 25.65
Polar Surface Area: 168 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 85.6±3.0 dyne/cm
Molar Volume: 244.6±3.0 cm3

Click to predict properties on the Chemicalize site


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