ChemSpider 2D Image | Methyl (6R)-5-acetamido-2,6-anhydro-3,5-dideoxy-2-(2-hydroxy-1,3-diphenyl-2-propanyl)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-lyxo-hexonate | C27H35NO9

Methyl (6R)-5-acetamido-2,6-anhydro-3,5-dideoxy-2-(2-hydroxy-1,3-diphenyl-2-propanyl)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-lyxo-hexonate

  • Molecular FormulaC27H35NO9
  • Average mass517.568 Da
  • Monoisotopic mass517.231201 Da
  • ChemSpider ID9354981

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(6R)-5-Acétamido-2,6-anhydro-3,5-didésoxy-2-(2-hydroxy-1,3-diphényl-2-propanyl)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-lyxo-hexonate de méthyle [French] [ACD/IUPAC Name]
Methyl (6R)-5-acetamido-2,6-anhydro-3,5-dideoxy-2-(2-hydroxy-1,3-diphenyl-2-propanyl)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-lyxo-hexonate [ACD/IUPAC Name]
Methyl-(6R)-5-acetamido-2,6-anhydro-3,5-didesoxy-2-(2-hydroxy-1,3-diphenyl-2-propanyl)-6-[(1R,2R)-1,2,3-trihydroxypropyl]-L-lyxo-hexonat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 800.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.1±3.0 kJ/mol
Flash Point: 438.0±34.3 °C
Index of Refraction: 1.624
Molar Refractivity: 133.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.00
ACD/BCF (pH 5.5): 3.41
ACD/KOC (pH 5.5): 83.73
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 3.41
ACD/KOC (pH 7.4): 83.73
Polar Surface Area: 166 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 69.8±5.0 dyne/cm
Molar Volume: 379.1±5.0 cm3

Click to predict properties on the Chemicalize site


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