ChemSpider 2D Image | (1S)-1,5-Anhydro-2,3,4-tris-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-xylitol | C29H56O5SSi3

(1S)-1,5-Anhydro-2,3,4-tris-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-xylitol

  • Molecular FormulaC29H56O5SSi3
  • Average mass601.073 Da
  • Monoisotopic mass600.315613 Da
  • ChemSpider ID23078587

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-2,3,4-tris-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-xylitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2,3,4-tris-O-[dimethyl(2-methyl-2-propanyl)silyl]-1-[(S)-phenylsulfinyl]-D-xylitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-2,3,4-tris-O-[diméthyl(2-méthyl-2-propanyl)silyl]-1-[(S)-phénylsulfinyl]-D-xylitol [French] [ACD/IUPAC Name]
D-Xylitol, 1,5-anhydro-2,3,4-tris-O-[(1,1-dimethylethyl)dimethylsilyl]-1-C-[(S)-phenylsulfinyl]-, (1S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 564.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 81.6±3.0 kJ/mol
Flash Point: 295.0±30.1 °C
Index of Refraction: 1.499
Molar Refractivity: 173.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 9.42
ACD/LogD (pH 5.5): 8.42
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 906597.75
ACD/LogD (pH 7.4): 8.42
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 906597.75
Polar Surface Area: 73 Å2
Polarizability: 68.7±0.5 10-24cm3
Surface Tension: 32.7±5.0 dyne/cm
Molar Volume: 589.8±5.0 cm3

Click to predict properties on the Chemicalize site


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