ChemSpider 2D Image | Bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl] sebacate | C22H26O10

Bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl] sebacate

  • Molecular FormulaC22H26O10
  • Average mass450.436 Da
  • Monoisotopic mass450.152588 Da
  • ChemSpider ID57514938

More details:






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

Bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl] sebacate [ACD/IUPAC Name]
Bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl]sebacat [German] [ACD/IUPAC Name]
Decanedioic acid, bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl] ester [ACD/Index Name]
Sébacate de bis[6-(hydroxyméthyl)-4-oxo-4H-pyran-3-yle] [French] [ACD/IUPAC Name]
62902-15-2 [RN]
Bis(6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl) decanedioate
Bis[6-(hydroxymethyl)-4-oxo-4H-pyran-3-yl] decanedioate
BIS[6-(HYDROXYMETHYL)-4-OXOPYRAN-3-YL] DECANEDIOATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 720.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 120.3±6.0 kJ/mol
Flash Point: 248.6±26.4 °C
Index of Refraction: 1.572
Molar Refractivity: 109.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 2.64
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.70
ACD/KOC (pH 5.5): 202.36
ACD/LogD (pH 7.4): 1.71
ACD/BCF (pH 7.4): 11.70
ACD/KOC (pH 7.4): 202.36
Polar Surface Area: 146 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 60.4±5.0 dyne/cm
Molar Volume: 331.4±5.0 cm3

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