ChemSpider 2D Image | 3-Hexyl-5-hydroxyphenyl 2-(beta-D-galactofuranosyloxy)-6-hexyl-4-hydroxybenzoate | C31H44O10

3-Hexyl-5-hydroxyphenyl 2-(β-D-galactofuranosyloxy)-6-hexyl-4-hydroxybenzoate

  • Molecular FormulaC31H44O10
  • Average mass576.675 Da
  • Monoisotopic mass576.293457 Da
  • ChemSpider ID8005403

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

2-(β-D-Galactofuranosyloxy)-6-hexyl-4-hydroxybenzoate de 3-hexyl-5-hydroxyphényle [French] [ACD/IUPAC Name]
3-Hexyl-5-hydroxyphenyl 2-(β-D-galactofuranosyloxy)-6-hexyl-4-hydroxybenzoate [ACD/IUPAC Name]
3-Hexyl-5-hydroxyphenyl-2-(β-D-galactofuranosyloxy)-6-hexyl-4-hydroxybenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2-(β-D-galactofuranosyloxy)-6-hexyl-4-hydroxy-, 3-hexyl-5-hydroxyphenyl ester [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: 810.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.5±3.0 kJ/mol
Flash Point: 258.3±27.8 °C
Index of Refraction: 1.594
Molar Refractivity: 153.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 4
ACD/LogP: 6.57
ACD/LogD (pH 5.5): 5.51
ACD/BCF (pH 5.5): 9141.92
ACD/KOC (pH 5.5): 23778.21
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 6252.07
ACD/KOC (pH 7.4): 16261.70
Polar Surface Area: 166 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 451.8±3.0 cm3

Click to predict properties on the Chemicalize site


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