ChemSpider 2D Image | Methyl hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranoside | C19H34O16

Methyl hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranoside

  • Molecular FormulaC19H34O16
  • Average mass518.464 Da
  • Monoisotopic mass518.184692 Da
  • ChemSpider ID3718581

More details:






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

Hexopyranoside, methyl O-hexopyranosyl-(1->3)-O-[hexopyranosyl-(1->6)]- [ACD/Index Name]
Hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl hexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranoside [ACD/IUPAC Name]
Methylhexopyranosyl-(1->3)-[hexopyranosyl-(1->6)]hexopyranosid [German] [ACD/IUPAC Name]
2-[(3,5-DIHYDROXY-6-METHOXY-4-{[3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}OXAN-2-YL)METHOXY]-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
2-[3,5-dihydroxy-2-methoxy-6-(3,4,5-trihydroxy-6-hydroxymethyltetrahydro-2H-2-pyranyloxymethyl)tetrahydro-2H-4-pyranyloxy]-6-hydroxymethyltetrahydro-2H-3,4,5-pyrantriol
68601-74-1 [RN]
α1,3α1,6-MANNOTRIOSE, α-METHYL GLYCOSIDE

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

Density: 1.7±0.1 g/cm3
Boiling Point: 861.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.3±6.0 kJ/mol
Flash Point: 474.8±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 109.4±0.4 cm3
#H bond acceptors: 16
#H bond donors: 10
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -5.50
ACD/LogD (pH 5.5): -5.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 258 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 101.9±5.0 dyne/cm
Molar Volume: 303.5±5.0 cm3

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