ChemSpider 2D Image | (2S,3R,4S,5S,6S)-2-Azido-5-{[(2R,4R,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4-diol (non-preferred name) | C12H21N3O9

(2S,3R,4S,5S,6S)-2-Azido-5-{[(2R,4R,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4-diol (non-preferred name)

  • Molecular FormulaC12H21N3O9
  • Average mass351.310 Da
  • Monoisotopic mass351.127777 Da
  • ChemSpider ID62300128

  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2S,3R,4S,5S,6S)-2-Azido-5-{[(2R,4R,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4-diol (non-preferred name) [German] [ACD/IUPAC Name]
(2S,3R,4S,5S,6S)-2-Azido-5-{[(2R,4R,5S,6S)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-3,4-diol (non-preferred name) [ACD/IUPAC Name]
(2S,3R,4S,5S,6S)-2-Azido-5-{[(2R,4R,5S,6S)-4,5-dihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]oxy}-6-(hydroxyméthyl)tétrahydro-2H-pyrane-3,4-diol (non-preferred name) [French] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -0.59
ACD/LogD (pH 5.5): -1.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.21
ACD/LogD (pH 7.4): -1.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.21
Polar Surface Area: 161 Å2
Polarizability:
Surface Tension:
Molar Volume:

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