ChemSpider 2D Image | 6-Deoxy-1-O-(3-methylbutanoyl)-alpha-L-mannopyranose | C11H20O6

6-Deoxy-1-O-(3-methylbutanoyl)-α-L-mannopyranose

  • Molecular FormulaC11H20O6
  • Average mass248.273 Da
  • Monoisotopic mass248.125992 Da
  • ChemSpider ID68048316

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

6-Deoxy-1-O-(3-methylbutanoyl)-α-L-mannopyranose [ACD/IUPAC Name]
6-Desoxy-1-O-(3-methylbutanoyl)-α-L-mannopyranose [German] [ACD/IUPAC Name]
6-Désoxy-1-O-(3-méthylbutanoyl)-α-L-mannopyranose [French] [ACD/IUPAC Name]
α-L-Mannopyranose, 6-deoxy-, 1-(3-methylbutanoate) [ACD/Index Name]
[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] 3-methylbutanoate
Compound NP-021699

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

Density: 1.3±0.1 g/cm3
Boiling Point: 358.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 69.9±6.0 kJ/mol
Flash Point: 131.8±21.4 °C
Index of Refraction: 1.509
Molar Refractivity: 59.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.85
ACD/LogD (pH 5.5): 0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 24.50
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.50
Polar Surface Area: 96 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 50.2±5.0 dyne/cm
Molar Volume: 197.5±5.0 cm3

Click to predict properties on the Chemicalize site


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