ChemSpider 2D Image | (3E)-6-Hydroxy-3-(5-hydroxy-3-oxo-4-undecyl-2(3H)-furanylidene)-5-methoxy-7-undecyl-1-benzofuran-2(3H)-one | C35H52O7

(3E)-6-Hydroxy-3-(5-hydroxy-3-oxo-4-undecyl-2(3H)-furanylidene)-5-methoxy-7-undecyl-1-benzofuran-2(3H)-one

  • Molecular FormulaC35H52O7
  • Average mass584.783 Da
  • Monoisotopic mass584.371277 Da
  • ChemSpider ID9355868

  • Double-bond stereo - Double-bond stereo

More details:

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

(3E)-6-Hydroxy-3-(5-hydroxy-3-oxo-4-undecyl-2(3H)-furanyliden)-5-methoxy-7-undecyl-1-benzofuran-2(3H)-on [German] [ACD/IUPAC Name]
(3E)-6-Hydroxy-3-(5-hydroxy-3-oxo-4-undecyl-2(3H)-furanylidene)-5-methoxy-7-undecyl-1-benzofuran-2(3H)-one [ACD/IUPAC Name]
(3E)-6-Hydroxy-3-(5-hydroxy-3-oxo-4-undécyl-2(3H)-furanylidène)-5-méthoxy-7-undécyl-1-benzofuran-2(3H)-one [French] [ACD/IUPAC Name]
2(3H)-Benzofuranone, 6-hydroxy-3-(5-hydroxy-3-oxo-4-undecyl-2(3H)-furanylidene)-5-methoxy-7-undecyl-, (3E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 717.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 218.0±26.4 °C
Index of Refraction: 1.547
Molar Refractivity: 165.4±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 11.45
ACD/LogD (pH 5.5): 9.70
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1462199.50
ACD/LogD (pH 7.4): 7.93
ACD/BCF (pH 7.4): 129006.17
ACD/KOC (pH 7.4): 24639.08
Polar Surface Area: 102 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 47.0±3.0 dyne/cm
Molar Volume: 521.5±3.0 cm3

Click to predict properties on the Chemicalize site


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