ChemSpider 2D Image | 6-O-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-tryptophyl)-D-glucopyranose | C22H30N2O9

6-O-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-tryptophyl)-D-glucopyranose

  • Molecular FormulaC22H30N2O9
  • Average mass466.482 Da
  • Monoisotopic mass466.195129 Da
  • ChemSpider ID68476907

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

6-O-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-tryptophyl)-D-glucopyranose [German] [ACD/IUPAC Name]
6-O-(N-{[(2-Methyl-2-propanyl)oxy]carbonyl}-D-tryptophyl)-D-glucopyranose [ACD/IUPAC Name]
6-O-(N-{[(2-Méthyl-2-propanyl)oxy]carbonyl}-D-tryptophyl)-D-glucopyranose [French] [ACD/IUPAC Name]
D-Glucopyranose, 6-O-[N-[(1,1-dimethylethoxy)carbonyl]-D-tryptophyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 722.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 110.8±3.0 kJ/mol
Flash Point: 391.0±32.9 °C
Index of Refraction: 1.630
Molar Refractivity: 116.6±0.3 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.77
ACD/LogD (pH 5.5): 1.59
ACD/BCF (pH 5.5): 9.44
ACD/KOC (pH 5.5): 173.62
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 9.44
ACD/KOC (pH 7.4): 173.57
Polar Surface Area: 171 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 61.9±3.0 dyne/cm
Molar Volume: 327.9±3.0 cm3

Click to predict properties on the Chemicalize site


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