Found 10 results

Search term: IFCAMEQHKHEHBS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2xi)-1,6-Di-O-acetyl-2,3,4-tri-O-benzyl-beta-D-arabino-hexopyranose | C31H34O8

(2ξ)-1,6-Di-O-acetyl-2,3,4-tri-O-benzyl-β-D-arabino-hexopyranose

  • Molecular FormulaC31H34O8
  • Average mass534.597 Da
  • Monoisotopic mass534.225342 Da
  • ChemSpider ID58170946

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(2ξ)-1,6-Di-O-acetyl-2,3,4-tri-O-benzyl-β-D-arabino-hexopyranose [German] [ACD/IUPAC Name]
(2ξ)-1,6-Di-O-acetyl-2,3,4-tri-O-benzyl-β-D-arabino-hexopyranose [ACD/IUPAC Name]
(2ξ)-1,6-Di-O-acétyl-2,3,4-tri-O-benzyl-β-D-arabino-hexopyranose [French] [ACD/IUPAC Name]
β-D-arabino-Hexopyranose, 2,3,4-tris-O-(phenylmethyl)-, diacetate, (2ξ)- [ACD/Index Name]
((2R,3R,4S,6S)-6-Acetoxy-3,4,5-tris(benzyloxy)tetrahydro-2H-pyran-2-yl)methyl acetate
59433-13-5 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 625.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 262.3±31.5 °C
Index of Refraction: 1.581
Molar Refractivity: 144.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.38
ACD/LogD (pH 5.5): 6.28
ACD/BCF (pH 5.5): 35223.46
ACD/KOC (pH 5.5): 62546.93
ACD/LogD (pH 7.4): 6.28
ACD/BCF (pH 7.4): 35223.46
ACD/KOC (pH 7.4): 62546.93
Polar Surface Area: 90 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 434.7±5.0 cm3

Click to predict properties on the Chemicalize site


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