ChemSpider 2D Image | Methyl 2,3,6-tri-O-benzoylhexopyranoside | C28H26O9

Methyl 2,3,6-tri-O-benzoylhexopyranoside

  • Molecular FormulaC28H26O9
  • Average mass506.501 Da
  • Monoisotopic mass506.157684 Da
  • ChemSpider ID211787

More details:

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

2,3,6-Tri-O-benzoylhexopyranoside de méthyle [French] [ACD/IUPAC Name]
Hexopyranoside, methyl, 2,3,6-tribenzoate [ACD/Index Name]
Methyl 2,3,6-tri-O-benzoylhexopyranoside [ACD/IUPAC Name]
Methyl-2,3,6-tri-O-benzoylhexopyranosid [German] [ACD/IUPAC Name]
[4,5-BIS(BENZOYLOXY)-3-HYDROXY-6-METHOXYOXAN-2-YL]METHYL BENZOATE
3601-36-3 [RN]
6344-46-3 [RN]
methyl d-galactopyranoside 2,3,6-tribenzoate

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

NSC50742 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 666.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 220.3±25.0 °C
Index of Refraction: 1.616
Molar Refractivity: 130.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.90
ACD/LogD (pH 5.5): 5.49
ACD/BCF (pH 5.5): 8674.72
ACD/KOC (pH 5.5): 22939.99
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 8674.62
ACD/KOC (pH 7.4): 22939.74
Polar Surface Area: 118 Å2
Polarizability: 51.9±0.5 10-24cm3
Surface Tension: 61.0±5.0 dyne/cm
Molar Volume: 374.5±5.0 cm3

Click to predict properties on the Chemicalize site


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