ChemSpider 2D Image | Hex-2-ulofuranosyl hexopyranosyl-(1->6)hexopyranosyl-(1->6)hexopyranoside | C24H42O21

Hex-2-ulofuranosyl hexopyranosyl-(1->6)hexopyranosyl-(1->6)hexopyranoside

  • Molecular FormulaC24H42O21
  • Average mass666.578 Da
  • Monoisotopic mass666.221863 Da
  • ChemSpider ID3493964

More details:

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

Hex-2-ulofuranosyl hexopyranosyl-(1->6)hexopyranosyl-(1->6)hexopyranoside [ACD/IUPAC Name]
Hex-2-ulofuranosylhexopyranosyl-(1->6)hexopyranosyl-(1->6)hexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside, 2-hexulofuranosyl O-hexopyranosyl-(1->6)-O-hexopyranosyl-(1->6)- [ACD/Index Name]
Hexopyranosyl-(1->6)hexopyranosyl-(1->6)hexopyranoside d'hex-2-ulofuranosyle [French] [ACD/IUPAC Name]
(2R,3R,4S,5S,6R)-2-[[(2R,3S,4S,5R,6R)-6-[(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5S)-3,4-dihydroxy-2,5-&lt;i>bis</i>;(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxy-oxan-2-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol*&;α;-D-Galp-(1->6)-&α;-D-Galp-(1->6)-&α;-D-Glcp-(1<->2)-&amp;β;-D-Fruf
stachyose [Wiki]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 1044.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 172.9±6.0 kJ/mol
Flash Point: 585.3±34.3 °C
Index of Refraction: 1.690
Molar Refractivity: 138.3±0.4 cm3
#H bond acceptors: 21
#H bond donors: 14
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -2.88
ACD/LogD (pH 5.5): -3.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 348 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 126.4±5.0 dyne/cm
Molar Volume: 362.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement