ChemSpider 2D Image | 1-[2,3,4,6-Tetrakis-O-(2,2-dimethylpropanoyl)-beta-D-galactopyranosyl]-2(1H)-pyridinone | C31H47NO10

1-[2,3,4,6-Tetrakis-O-(2,2-dimethylpropanoyl)-β-D-galactopyranosyl]-2(1H)-pyridinone

  • Molecular FormulaC31H47NO10
  • Average mass593.706 Da
  • Monoisotopic mass593.320007 Da
  • ChemSpider ID9665075

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1-[2,3,4,6-Tetrakis-O-(2,2-dimethylpropanoyl)-β-D-galactopyranosyl]-2(1H)-pyridinon [German] [ACD/IUPAC Name]
1-[2,3,4,6-Tetrakis-O-(2,2-dimethylpropanoyl)-β-D-galactopyranosyl]-2(1H)-pyridinone [ACD/IUPAC Name]
1-[2,3,4,6-Tétrakis-O-(2,2-diméthylpropanoyl)-β-D-galactopyranosyl]-2(1H)-pyridinone [French] [ACD/IUPAC Name]
2(1H)-Pyridinone, 1-[2,3,4,6-tetrakis-O-(2,2-dimethyl-1-oxopropyl)-β-D-galactopyranosyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 635.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.9±31.5 °C
Index of Refraction: 1.518
Molar Refractivity: 154.4±0.4 cm3
#H bond acceptors: 11
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 6.19
ACD/LogD (pH 5.5): 5.59
ACD/BCF (pH 5.5): 10459.83
ACD/KOC (pH 5.5): 26227.96
ACD/LogD (pH 7.4): 5.59
ACD/BCF (pH 7.4): 10459.85
ACD/KOC (pH 7.4): 26228.02
Polar Surface Area: 135 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 44.7±5.0 dyne/cm
Molar Volume: 509.2±5.0 cm3

Click to predict properties on the Chemicalize site


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