ChemSpider 2D Image | (1S)-1-Ethoxy-2-(phenylsulfinyl)ethyl 2,3,4,6-tetra-O-acetyl-alpha-D-glucopyranoside | C24H32O12S

(1S)-1-Ethoxy-2-(phenylsulfinyl)ethyl 2,3,4,6-tetra-O-acetyl-α-D-glucopyranoside

  • Molecular FormulaC24H32O12S
  • Average mass544.569 Da
  • Monoisotopic mass544.161438 Da
  • ChemSpider ID26604967

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(1S)-1-Ethoxy-2-(phenylsulfinyl)ethyl 2,3,4,6-tetra-O-acetyl-α-D-glucopyranoside [ACD/IUPAC Name]
(1S)-1-Ethoxy-2-(phenylsulfinyl)ethyl-2,3,4,6-tetra-O-acetyl-α-D-glucopyranosid [German] [ACD/IUPAC Name]
2,3,4,6-Tétra-O-acétyl-α-D-glucopyranoside de (1S)-1-éthoxy-2-(phénylsulfinyl)éthyle [French] [ACD/IUPAC Name]
α-D-Glucopyranoside, (1S)-1-ethoxy-2-(phenylsulfinyl)ethyl, tetraacetate [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 625.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 332.1±31.5 °C
Index of Refraction: 1.547
Molar Refractivity: 129.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 52.57
ACD/KOC (pH 5.5): 593.35
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.57
ACD/KOC (pH 7.4): 593.35
Polar Surface Area: 169 Å2
Polarizability: 51.3±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 408.5±5.0 cm3

Click to predict properties on the Chemicalize site


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