ChemSpider 2D Image | Dimethyl (6R)-5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2-dihydroxy-4-phosphonobutyl]-alpha-L-threo-hex-2-ulopyranosidonate | C14H26NO11P

Dimethyl (6R)-5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2-dihydroxy-4-phosphonobutyl]-α-L-threo-hex-2-ulopyranosidonate

  • Molecular FormulaC14H26NO11P
  • Average mass415.330 Da
  • Monoisotopic mass415.124359 Da
  • ChemSpider ID30842996

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(6R)-5-Acétamido-3,5-didésoxy-6-[(1R,2R)-1,2-dihydroxy-4-phosphonobutyl]-α-L-thréo-hex-2-ulopyranosidonate de diméthyle [French] [ACD/IUPAC Name]
D-glycero-β-D-galacto-2-Deculopyranosidonic acid, methyl 5-(acetylamino)-3,5,9,10-tetradeoxy-10-phosphono-, methyl ester [ACD/Index Name]
Dimethyl (6R)-5-acetamido-3,5-dideoxy-6-[(1R,2R)-1,2-dihydroxy-4-phosphonobutyl]-α-L-threo-hex-2-ulopyranosidonate [ACD/IUPAC Name]
Dimethyl-(6R)-5-acetamido-3,5-didesoxy-6-[(1R,2R)-1,2-dihydroxy-4-phosphonobutyl]-α-L-threo-hex-2-ulopyranosidonat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.550
Molar Refractivity: 88.2±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -2.97
ACD/LogD (pH 5.5): -5.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 70.8±5.0 dyne/cm
Molar Volume: 276.9±5.0 cm3

Click to predict properties on the Chemicalize site


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