ChemSpider 2D Image | Methyl 4-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-ethylhexopyranoside | C29H54O16

Methyl 4-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-ethylhexopyranoside

  • Molecular FormulaC29H54O16
  • Average mass658.729 Da
  • Monoisotopic mass658.341187 Da
  • ChemSpider ID21242898

More details:

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

4-O-Méthylhexopyranosyl-(1->4)-2,3,6-tri-O-méthylhexopyranosyl-(1->4)-2,3,6-tri-O-éthylhexopyranoside de méthyle [French] [ACD/IUPAC Name]
Hexopyranoside, methyl O--4-O-methylhexopyranosyl-(1->4)-O--2,3,6-tri-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-ethyl- [ACD/Index Name]
Methyl 4-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-ethylhexopyranoside [ACD/IUPAC Name]
Methyl-4-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-methylhexopyranosyl-(1->4)-2,3,6-tri-O-ethylhexopyranosid [German] [ACD/IUPAC 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: 727.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.3±6.0 kJ/mol
Flash Point: 393.7±32.9 °C
Index of Refraction: 1.510
Molar Refractivity: 157.1±0.4 cm3
#H bond acceptors: 16
#H bond donors: 3
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 2
ACD/LogP: 1.13
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.16
ACD/KOC (pH 5.5): 38.61
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.16
ACD/KOC (pH 7.4): 38.61
Polar Surface Area: 181 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 525.2±5.0 cm3

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