ChemSpider 2D Image | {(2S,2'R,3'R,4'S,5'R)-3',4'-Bis(benzyloxy)-5'-[2-(benzyloxy)ethyl]octahydro-2,2'-bifuran-5-yl}methanol | C32H38O6

{(2S,2'R,3'R,4'S,5'R)-3',4'-Bis(benzyloxy)-5'-[2-(benzyloxy)ethyl]octahydro-2,2'-bifuran-5-yl}methanol

  • Molecular FormulaC32H38O6
  • Average mass518.641 Da
  • Monoisotopic mass518.266846 Da
  • ChemSpider ID9435923

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

{(2S,2'R,3'R,4'S,5'R)-3',4'-Bis(benzyloxy)-5'-[2-(benzyloxy)ethyl]octahydro-2,2'-bifuran-5-yl}methanol [ACD/IUPAC Name]
{(2S,2'R,3'R,4'S,5'R)-3',4'-Bis(benzyloxy)-5'-[2-(benzyloxy)ethyl]octahydro-2,2'-bifuran-5-yl}methanol [German] [ACD/IUPAC Name]
{(2S,2'R,3'R,4'S,5'R)-3',4'-Bis(benzyloxy)-5'-[2-(benzyloxy)éthyl]octahydro-2,2'-bifuran-5-yl}méthanol [French] [ACD/IUPAC Name]
D-glycero-L-ido-Undecitol, 2,5:6,9-dianhydro-3,4,10-trideoxy-7,8,11-tris-O-(phenylmethyl)-, (2ξ)- [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: 641.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.5±3.0 kJ/mol
Flash Point: 341.7±31.5 °C
Index of Refraction: 1.599
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.13
ACD/LogD (pH 5.5): 5.64
ACD/BCF (pH 5.5): 11418.26
ACD/KOC (pH 5.5): 27926.64
ACD/LogD (pH 7.4): 5.64
ACD/BCF (pH 7.4): 11418.26
ACD/KOC (pH 7.4): 27926.64
Polar Surface Area: 66 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 430.3±5.0 cm3

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