Found 9 results

Search term: DFUALJIUMYYHRG-DWBMWBIPSA-N (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-(beta-D-Glucopyranosyloxy)-1,2-propanediyl dihexadecanoate | C41H78O10

3-(β-D-Glucopyranosyloxy)-1,2-propanediyl dihexadecanoate

  • Molecular FormulaC41H78O10
  • Average mass731.052 Da
  • Monoisotopic mass730.559509 Da
  • ChemSpider ID31146988

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

3-(β-D-Glucopyranosyloxy)-1,2-propandiyl-dihexadecanoat [German] [ACD/IUPAC Name]
3-(β-D-Glucopyranosyloxy)-1,2-propanediyl dihexadecanoate [ACD/IUPAC Name]
Dihexadécanoate de 3-(β-D-glucopyranosyloxy)-1,2-propanediyle [French] [ACD/IUPAC Name]
Hexadecanoic acid, 1-[(β-D-glucopyranosyloxy)methyl]-1,2-ethanediyl ester [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: 793.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.4±6.0 kJ/mol
Flash Point: 223.0±26.4 °C
Index of Refraction: 1.503
Molar Refractivity: 203.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 37
#Rule of 5 Violations: 3
ACD/LogP: 12.57
ACD/LogD (pH 5.5): 11.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 152 Å2
Polarizability: 80.5±0.5 10-24cm3
Surface Tension: 46.2±5.0 dyne/cm
Molar Volume: 687.0±5.0 cm3

Click to predict properties on the Chemicalize site


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