ChemSpider 2D Image | 3,5,6-Tri-O-benzoyl-1,2-O-isopropylidene-alpha-D-glucofuranose | C30H28O9

3,5,6-Tri-O-benzoyl-1,2-O-isopropylidene-α-D-glucofuranose

  • Molecular FormulaC30H28O9
  • Average mass532.538 Da
  • Monoisotopic mass532.173340 Da
  • ChemSpider ID27474177

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3,5,6-Tri-O-benzoyl-1,2-O-isopropylidene-α-D-glucofuranose [ACD/IUPAC Name]
3,5,6-Tri-O-benzoyl-1,2-O-isopropylidène-α-D-glucofuranose [French] [ACD/IUPAC Name]
3,5,6-Tri-O-benzoyl-1,2-O-isopropyliden-α-D-glucofuranose [German] [ACD/IUPAC Name]
6339-03-3 [RN]
α-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tribenzoate [ACD/Index Name]
1,2-O-Isopropylidene-3,5,6-tri-O-benzoyl-α-D-g
1,2-O-ISOPROPYLIDENE-3,5,6-TRI-O-BENZOYL-α-D-GLUCOFURANOSE
1,2-O-ISOPROPYLIDENE-3,5,6-TRI-O-BENZOYL-α-D-GLUCOFURANOSE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 646.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 273.2±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 138.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.29
ACD/LogD (pH 5.5): 6.71
ACD/BCF (pH 5.5): 73820.57
ACD/KOC (pH 5.5): 106223.78
ACD/LogD (pH 7.4): 6.71
ACD/BCF (pH 7.4): 73820.57
ACD/KOC (pH 7.4): 106223.78
Polar Surface Area: 107 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 58.3±5.0 dyne/cm
Molar Volume: 397.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement