ChemSpider 2D Image | 3-O-[(4-Methylphenyl)sulfonyl]-beta-L-altropyranose | C13H18O8S

3-O-[(4-Methylphenyl)sulfonyl]-β-L-altropyranose

  • Molecular FormulaC13H18O8S
  • Average mass334.342 Da
  • Monoisotopic mass334.072235 Da
  • ChemSpider ID62654876

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

3-O-[(4-Methylphenyl)sulfonyl]-β-L-altropyranose [German] [ACD/IUPAC Name]
3-O-[(4-Methylphenyl)sulfonyl]-β-L-altropyranose [ACD/IUPAC Name]
3-O-[(4-Méthylphényl)sulfonyl]-β-L-altropyranose [French] [ACD/IUPAC Name]
β-L-Altropyranose, 3-(4-methylbenzenesulfonate) [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: 599.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 316.4±30.1 °C
Index of Refraction: 1.635
Molar Refractivity: 75.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.85
ACD/LogD (pH 7.4): -0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.85
Polar Surface Area: 142 Å2
Polarizability: 29.9±0.5 10-24cm3
Surface Tension: 80.5±5.0 dyne/cm
Molar Volume: 210.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement