ChemSpider 2D Image | Ethyl 2-{(R)-acetoxy[(2,3,4,6-tetra-O-acetyl-beta-D-glucopyranosyl)oxy]methyl}acrylate | C22H30O14

Ethyl 2-{(R)-acetoxy[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]methyl}acrylate

  • Molecular FormulaC22H30O14
  • Average mass518.465 Da
  • Monoisotopic mass518.163574 Da
  • ChemSpider ID9014934

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

2-{(R)-Acétoxy[(2,3,4,6-tétra-O-acétyl-β-D-glucopyranosyl)oxy]méthyl}acrylate d'éthyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 2-[(R)-(acetyloxy)[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]methyl]-, ethyl ester [ACD/Index Name]
Ethyl 2-{(R)-acetoxy[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]methyl}acrylate [ACD/IUPAC Name]
Ethyl-2-{(R)-acetoxy[(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)oxy]methyl}acrylat [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 557.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 236.2±30.2 °C
Index of Refraction: 1.492
Molar Refractivity: 115.9±0.4 cm3
#H bond acceptors: 14
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 4.66
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 34.66
ACD/KOC (pH 5.5): 440.40
ACD/LogD (pH 7.4): 2.33
ACD/BCF (pH 7.4): 34.66
ACD/KOC (pH 7.4): 440.40
Polar Surface Area: 176 Å2
Polarizability: 45.9±0.5 10-24cm3
Surface Tension: 47.6±5.0 dyne/cm
Molar Volume: 399.3±5.0 cm3

Click to predict properties on the Chemicalize site


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