ChemSpider 2D Image | Methyl 4,5-Bis(Acetylamino)-3,4,5-Trideoxy-D-Glycero-Alpha-D-Galacto-Non-2-Ulopyranosidonic Acid | C14H24N2O9

Methyl 4,5-Bis(Acetylamino)-3,4,5-Trideoxy-D-Glycero-α-D-Galacto-Non-2-Ulopyranosidonic Acid

  • Molecular FormulaC14H24N2O9
  • Average mass364.348 Da
  • Monoisotopic mass364.148193 Da
  • ChemSpider ID59053006
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

Acide (6R)-4,5-diacétamido-3,4,5-tridésoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-thréo-hex-2-ulopyranosidonique de méthyle [French] [ACD/IUPAC Name]
D-glycero-α-D-galacto-2-Nonulopyranosidonic acid, methyl 4,5-bis(acetylamino)-3,4,5-trideoxy- [ACD/Index Name]
Methyl (6R)-4,5-diacetamido-3,4,5-trideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranosidonic acid [ACD/IUPAC Name]
Methyl 4,5-Bis(Acetylamino)-3,4,5-Trideoxy-D-Glycero-α-D-Galacto-Non-2-Ulopyranosidonic Acid
Methyl-(6R)-4,5-diacetamido-3,4,5-tridesoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranosidonsäure [German] [ACD/IUPAC Name]
6KL

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 810.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 134.2±6.0 kJ/mol
Flash Point: 444.0±34.3 °C
Index of Refraction: 1.563
Molar Refractivity: 82.0±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -2.87
ACD/LogD (pH 5.5): -5.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 175 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 69.2±5.0 dyne/cm
Molar Volume: 252.5±5.0 cm3

Click to predict properties on the Chemicalize site






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