ChemSpider 2D Image | Octyl 3-deoxy-2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-xylo-hexopyranoside | C20H38O9

Octyl 3-deoxy-2-O-(6-deoxy-α-L-galactopyranosyl)-β-D-xylo-hexopyranoside

  • Molecular FormulaC20H38O9
  • Average mass422.510 Da
  • Monoisotopic mass422.251587 Da
  • ChemSpider ID25061191

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

3-Désoxy-2-O-(6-désoxy-α-L-galactopyranosyl)-β-D-xylo-hexopyranoside d'octyle [French] [ACD/IUPAC Name]
Octyl 3-deoxy-2-O-(6-deoxy-α-L-galactopyranosyl)-β-D-xylo-hexopyranoside [ACD/IUPAC Name]
Octyl-3-desoxy-2-O-(6-desoxy-α-L-galactopyranosyl)-β-D-xylo-hexopyranosid [German] [ACD/IUPAC Name]
β-D-xylo-Hexopyranoside, octyl 3-deoxy-2-O-(6-deoxy-α-L-galactopyranosyl)- [ACD/Index Name]
(2S,3S,4R,5S,6S)-2-{[(2R,3R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-(octyloxy)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
DA8

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

Density: 1.3±0.1 g/cm3
Boiling Point: 601.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.9 mmHg at 25°C
Enthalpy of Vaporization: 102.7±6.0 kJ/mol
Flash Point: 317.7±31.5 °C
Index of Refraction: 1.537
Molar Refractivity: 105.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 2.12
ACD/BCF (pH 5.5): 24.06
ACD/KOC (pH 5.5): 339.14
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 24.06
ACD/KOC (pH 7.4): 339.13
Polar Surface Area: 138 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 56.0±5.0 dyne/cm
Molar Volume: 336.5±5.0 cm3

Click to predict properties on the Chemicalize site


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