ChemSpider 2D Image | Hex-2-ulofuranosyl 2-O-dodecanoyl-3-O-isobutylhexopyranoside | C28H52O12

Hex-2-ulofuranosyl 2-O-dodecanoyl-3-O-isobutylhexopyranoside

  • Molecular FormulaC28H52O12
  • Average mass580.705 Da
  • Monoisotopic mass580.345886 Da
  • ChemSpider ID25047282

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

2-O-Dodecanoyl-3-O-isobutylhexopyranoside d'hex-2-ulofuranosyle [French] [ACD/IUPAC Name]
Hex-2-ulofuranosyl 2-O-dodecanoyl-3-O-isobutylhexopyranoside [ACD/IUPAC Name]
Hex-2-ulofuranosyl-2-O-dodecanoyl-3-O-isobutylhexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside, 2-hexulofuranosyl 3-O-(2-methylpropyl)-2-O-(1-oxododecyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 728.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.5±6.0 kJ/mol
Flash Point: 227.8±26.4 °C
Index of Refraction: 1.537
Molar Refractivity: 145.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 4
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 5.51
ACD/BCF (pH 5.5): 9050.52
ACD/KOC (pH 5.5): 23647.05
ACD/LogD (pH 7.4): 5.51
ACD/BCF (pH 7.4): 9050.44
ACD/KOC (pH 7.4): 23646.84
Polar Surface Area: 185 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 57.1±5.0 dyne/cm
Molar Volume: 465.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement