ChemSpider 2D Image | 1,6-Di-O-acetyl-beta-D-fructofuranosyl 2,3-bis-O-(5-methylhexanoyl)-alpha-D-glucopyranoside | C30H50O15

1,6-Di-O-acetyl-β-D-fructofuranosyl 2,3-bis-O-(5-methylhexanoyl)-α-D-glucopyranoside

  • Molecular FormulaC30H50O15
  • Average mass650.709 Da
  • Monoisotopic mass650.314941 Da
  • ChemSpider ID8185040

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

1,6-Di-O-acetyl-β-D-fructofuranosyl 2,3-bis-O-(5-methylhexanoyl)-α-D-glucopyranoside [ACD/IUPAC Name]
1,6-Di-O-acetyl-β-D-fructofuranosyl-2,3-bis-O-(5-methylhexanoyl)-α-D-glucopyranosid [German] [ACD/IUPAC Name]
2,3-Bis-O-(5-méthylhexanoyl)-α-D-glucopyranoside de 1,6-di-O-acétyl-β-D-fructofuranosyle [French] [ACD/IUPAC Name]
α-D-Glucopyranoside, 1,6-di-O-acetyl-β-D-fructofuranosyl 2,3-bis-O-(5-methyl-1-oxohexyl)- [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: 737.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.8±6.0 kJ/mol
Flash Point: 225.5±26.4 °C
Index of Refraction: 1.527
Molar Refractivity: 155.5±0.4 cm3
#H bond acceptors: 15
#H bond donors: 4
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: 5.72
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 451.14
ACD/KOC (pH 5.5): 2764.15
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 451.13
ACD/KOC (pH 7.4): 2764.09
Polar Surface Area: 214 Å2
Polarizability: 61.6±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 506.0±5.0 cm3

Click to predict properties on the Chemicalize site


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