ChemSpider 2D Image | (1S)-1,5-Anhydro-4,6-O-benzylidene-2,3-bis-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-glucitol | C31H48O6SSi2

(1S)-1,5-Anhydro-4,6-O-benzylidene-2,3-bis-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-glucitol

  • Molecular FormulaC31H48O6SSi2
  • Average mass604.945 Da
  • Monoisotopic mass604.270996 Da
  • ChemSpider ID23078589

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-4,6-O-benzyliden-2,3-bis-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-4,6-O-benzylidene-2,3-bis-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-4,6-O-benzylidène-2,3-bis-O-[diméthyl(2-méthyl-2-propanyl)silyl]-1-[(S)-phénylsulfinyl]-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-2,3-bis-O-[(1,1-dimethylethyl)dimethylsilyl]-4,6-O-(phenylmethylene)-1-C-[(S)-phenylsulfinyl]-, (1S)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 622.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.8±3.0 kJ/mol
Flash Point: 330.3±31.5 °C
Index of Refraction: 1.548
Molar Refractivity: 170.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 9.85
ACD/LogD (pH 5.5): 8.49
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 991978.81
ACD/LogD (pH 7.4): 8.49
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 991978.81
Polar Surface Area: 82 Å2
Polarizability: 67.5±0.5 10-24cm3
Surface Tension: 40.7±5.0 dyne/cm
Molar Volume: 536.4±5.0 cm3

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