ChemSpider 2D Image | 10-(beta-D-Glucopyranosyloxy)-4,6-decadiynoic acid | C16H22O8

10-(β-D-Glucopyranosyloxy)-4,6-decadiynoic acid

  • Molecular FormulaC16H22O8
  • Average mass342.341 Da
  • Monoisotopic mass342.131470 Da
  • ChemSpider ID29814738

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

10-(β-D-Glucopyranosyloxy)-4,6-decadiinsäure [German] [ACD/IUPAC Name]
10-(β-D-Glucopyranosyloxy)-4,6-decadiynoic acid [ACD/IUPAC Name]
4,6-Decadiynoic acid, 10-(β-D-glucopyranosyloxy)- [ACD/Index Name]
Acide 10-(β-D-glucopyranosyloxy)-4,6-décadiynoïque [French] [ACD/IUPAC Name]
10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxydeca-4,6-diynoic acid
Compound NP-018848

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

Density: 1.4±0.1 g/cm3
Boiling Point: 644.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 108.9±6.0 kJ/mol
Flash Point: 235.6±25.0 °C
Index of Refraction: 1.594
Molar Refractivity: 81.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -0.34
ACD/LogD (pH 5.5): -1.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 80.2±5.0 dyne/cm
Molar Volume: 239.5±5.0 cm3

Click to predict properties on the Chemicalize site


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