ChemSpider 2D Image | 3-Deoxy-1,2-O-isopropylidene-5-O-[(4-methylphenyl)sulfonyl]-beta-D-threo-pentofuranose | C15H20O6S

3-Deoxy-1,2-O-isopropylidene-5-O-[(4-methylphenyl)sulfonyl]-β-D-threo-pentofuranose

  • Molecular FormulaC15H20O6S
  • Average mass328.381 Da
  • Monoisotopic mass328.098053 Da
  • ChemSpider ID30657661

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

3-Deoxy-1,2-O-isopropylidene-5-O-[(4-methylphenyl)sulfonyl]-β-D-threo-pentofuranose [ACD/IUPAC Name]
3-Desoxy-1,2-O-isopropyliden-5-O-[(4-methylphenyl)sulfonyl]-β-D-threo-pentofuranose [German] [ACD/IUPAC Name]
3-Désoxy-1,2-O-isopropylidène-5-O-[(4-méthylphényl)sulfonyl]-β-D-thréo-pentofuranose [French] [ACD/IUPAC Name]
β-D-threo-Pentofuranose, 3-deoxy-1,2-O-(1-methylethylidene)-, 4-methylbenzenesulfonate [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 447.0±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 224.2±24.6 °C
Index of Refraction: 1.518
Molar Refractivity: 80.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 23.81
ACD/KOC (pH 5.5): 336.61
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 23.81
ACD/KOC (pH 7.4): 336.61
Polar Surface Area: 79 Å2
Polarizability: 31.7±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 264.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement