ChemSpider 2D Image | (1S)-1,5-Anhydro-4-O-beta-D-glucopyranosyl-1-(2-oxooctadecyl)-D-glucitol | C30H56O11

(1S)-1,5-Anhydro-4-O-β-D-glucopyranosyl-1-(2-oxooctadecyl)-D-glucitol

  • Molecular FormulaC30H56O11
  • Average mass592.759 Da
  • Monoisotopic mass592.382263 Da
  • ChemSpider ID8457498

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(1S)-1,5-Anhydro-4-O-β-D-glucopyranosyl-1-(2-oxooctadecyl)-D-glucitol [ACD/IUPAC Name]
(1S)-1,5-Anhydro-4-O-β-D-glucopyranosyl-1-(2-oxooctadecyl)-D-glucitol [German] [ACD/IUPAC Name]
(1S)-1,5-Anhydro-4-O-β-D-glucopyranosyl-1-(2-oxooctadécyl)-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,5-anhydro-4-O-β-D-glucopyranosyl-1-C-(2-oxooctadecyl)-, (1S)- [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: 765.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.9 mmHg at 25°C
Enthalpy of Vaporization: 127.1±6.0 kJ/mol
Flash Point: 237.4±26.4 °C
Index of Refraction: 1.545
Molar Refractivity: 152.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 601.59
ACD/KOC (pH 5.5): 3396.45
ACD/LogD (pH 7.4): 3.96
ACD/BCF (pH 7.4): 601.58
ACD/KOC (pH 7.4): 3396.42
Polar Surface Area: 186 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 58.7±5.0 dyne/cm
Molar Volume: 483.3±5.0 cm3

Click to predict properties on the Chemicalize site


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