ChemSpider 2D Image | 4-Acetamido-2,4-Didexoy-D-Glycero-Beta-D-Galacto-Octopyranosylphosphonic Acid | C10H20NO9P

4-Acetamido-2,4-Didexoy-D-Glycero-β-D-Galacto-Octopyranosylphosphonic Acid

  • Molecular FormulaC10H20NO9P
  • Average mass329.241 Da
  • Monoisotopic mass329.087555 Da
  • ChemSpider ID26330317

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,5S)-2-Acetamido-1,5-anhydro-2,4-dideoxy-5-phosphono-1-[(2S)-1,2,3-trihydroxypropyl]-D-threo-pentitol [ACD/IUPAC Name]
(1R,5S)-2-Acetamido-1,5-anhydro-2,4-didesoxy-5-phosphono-1-[(2S)-1,2,3-trihydroxypropyl]-D-threo-pentitol [German] [ACD/IUPAC Name]
(1R,5S)-2-Acétamido-1,5-anhydro-2,4-didésoxy-5-phosphono-1-[(2S)-1,2,3-trihydroxypropyl]-D-thréo-pentitol [French] [ACD/IUPAC Name]
4-Acetamido-2,4-Didexoy-D-Glycero-β-D-Galacto-Octopyranosylphosphonic Acid
L-gluco-Octitol, 4-(acetylamino)-1,5-anhydro-2,4-dideoxy-1-C-phosphono-, (1S)- [ACD/Index Name]
(2S,4R,5S,6R)-5-acetamido-4-hydroxy-6-[(1R,2S)-1,2,3-trihydroxypropyl]oxan-2-ylphosphonic acid
[(2S,4R,5S,6R)-5-acetamido-4-hydroxy-6-[(1R,2S)-1,2,3-trihydroxypropyl]oxan-2-yl]phosphonic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.589
Molar Refractivity: 67.6±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -4.84
ACD/LogD (pH 5.5): -6.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 187 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 88.8±5.0 dyne/cm
Molar Volume: 200.7±5.0 cm3

Click to predict properties on the Chemicalize site


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