ChemSpider 2D Image | [(2-Methyl-2-propanyl)amino]({(Z)-[(3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-piperidinylidene]amino}oxy)methanone | C11H21N3O6

[(2-Methyl-2-propanyl)amino]({(Z)-[(3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-piperidinylidene]amino}oxy)methanone

  • Molecular FormulaC11H21N3O6
  • Average mass291.301 Da
  • Monoisotopic mass291.143036 Da
  • ChemSpider ID39531152

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

[(2-Methyl-2-propanyl)amino]({(Z)-[(3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-piperidinyliden]amino}oxy)methanon [German] [ACD/IUPAC Name]
[(2-Methyl-2-propanyl)amino]({(Z)-[(3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-piperidinylidene]amino}oxy)methanone [ACD/IUPAC Name]
[(2-Méthyl-2-propanyl)amino]({(Z)-[(3S,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxyméthyl)-2-pipéridinylidène]amino}oxy)méthanone [French] [ACD/IUPAC Name]
2-Piperidinone, 3,4,5-trihydroxy-6-(hydroxymethyl)-, O-[[(1,1-dimethylethyl)amino]carbonyl]oxime, (2Z,3S,4S,5R,6R)- [ACD/Index Name]
O-(D-glucopyranosylidene) amino-Z-N-tert-Butylcarbamate

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.601
Molar Refractivity: 65.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -1.11
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.38
ACD/LogD (pH 7.4): -1.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.38
Polar Surface Area: 144 Å2
Polarizability: 26.0±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 191.0±7.0 cm3

Click to predict properties on the Chemicalize site


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