ChemSpider 2D Image | (8Z)-1-{5-[7-(5-Methyl-2-oxo-2,5-dihydro-3-furanyl)heptyl]tetrahydro-2-furanyl}-8-icosene-1,4,5-triyl triacetate | C42H70O9

(8Z)-1-{5-[7-(5-Methyl-2-oxo-2,5-dihydro-3-furanyl)heptyl]tetrahydro-2-furanyl}-8-icosene-1,4,5-triyl triacetate

  • Molecular FormulaC42H70O9
  • Average mass719.000 Da
  • Monoisotopic mass718.502014 Da
  • ChemSpider ID8208363

  • Double-bond stereo - Double-bond stereo

More details:

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

(8Z)-1-{5-[7-(5-Methyl-2-oxo-2,5-dihydro-3-furanyl)heptyl]tetrahydro-2-furanyl}-8-icosen-1,4,5-triyl-triacetat [German] [ACD/IUPAC Name]
(8Z)-1-{5-[7-(5-Methyl-2-oxo-2,5-dihydro-3-furanyl)heptyl]tetrahydro-2-furanyl}-8-icosene-1,4,5-triyl triacetate [ACD/IUPAC Name]
2(5H)-Furanone, 5-methyl-3-[7-[tetrahydro-5-[(8Z)-1,4,5-tris(acetyloxy)-8-eicosen-1-yl]-2-furanyl]heptyl]- [ACD/Index Name]
Triacétate de (8Z)-1-{5-[7-(5-méthyl-2-oxo-2,5-dihydro-3-furanyl)heptyl]tétrahydro-2-furanyl}-8-icosène-1,4,5-triyle [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 757.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.4±3.0 kJ/mol
Flash Point: 298.3±32.9 °C
Index of Refraction: 1.485
Molar Refractivity: 200.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 32
#Rule of 5 Violations: 2
ACD/LogP: 10.17
ACD/LogD (pH 5.5): 10.39
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.39
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 114 Å2
Polarizability: 79.6±0.5 10-24cm3
Surface Tension: 37.8±3.0 dyne/cm
Molar Volume: 700.0±3.0 cm3

Click to predict properties on the Chemicalize site


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