ChemSpider 2D Image | 4,5-O-Isopropylidene-1-O-sulfamoyl-beta-D-fructopyranose | C9H17NO8S

4,5-O-Isopropylidene-1-O-sulfamoyl-β-D-fructopyranose

  • Molecular FormulaC9H17NO8S
  • Average mass299.298 Da
  • Monoisotopic mass299.067474 Da
  • ChemSpider ID23935835

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

4,5-O-Isopropyliden-1-O-sulfamoyl-β-D-fructopyranose [German] [ACD/IUPAC Name]
4,5-O-Isopropylidene-1-O-sulfamoyl-β-D-fructopyranose [ACD/IUPAC Name]
4,5-O-Isopropylidène-1-O-sulfamoyl-β-D-fructopyranose [French] [ACD/IUPAC Name]
851957-35-2 [RN]
β-D-Fructopyranose, 1-O-(aminosulfonyl)-4,5-O-(1-methylethylidene)- [ACD/Index Name]
2,3-Desisopropylidene Topiramate
4,5-O-(1-Methylethylidene)-1-O-sulfamoyl-β-D-fructopyranose

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

Density: 1.5±0.1 g/cm3
Boiling Point: 504.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 89.1±6.0 kJ/mol
Flash Point: 259.0±32.9 °C
Index of Refraction: 1.543
Molar Refractivity: 62.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 30.57
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.85
Polar Surface Area: 146 Å2
Polarizability: 24.6±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 196.8±3.0 cm3

Click to predict properties on the Chemicalize site


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