ChemSpider 2D Image | (5E)-5-[(7E,9E)-13-(3-Furyl)-2,6,10-trimethyl-7,9-tridecadien-1-ylidene]-4-hydroxy-3-methyl-2(5H)-furanone | C25H34O4

(5E)-5-[(7E,9E)-13-(3-Furyl)-2,6,10-trimethyl-7,9-tridecadien-1-ylidene]-4-hydroxy-3-methyl-2(5H)-furanone

  • Molecular FormulaC25H34O4
  • Average mass398.535 Da
  • Monoisotopic mass398.245697 Da
  • ChemSpider ID32778137
  • Double-bond stereo - Double-bond stereo


More details:






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

(5E)-5-[(7E,9E)-13-(3-Furyl)-2,6,10-trimethyl-7,9-tridecadien-1-yliden]-4-hydroxy-3-methyl-2(5H)-furanon [German] [ACD/IUPAC Name]
(5E)-5-[(7E,9E)-13-(3-Furyl)-2,6,10-trimethyl-7,9-tridecadien-1-ylidene]-4-hydroxy-3-methyl-2(5H)-furanone [ACD/IUPAC Name]
(5E)-5-[(7E,9E)-13-(3-Furyl)-2,6,10-triméthyl-7,9-tridécadién-1-ylidène]-4-hydroxy-3-méthyl-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 5-[(7E,9E)-13-(3-furanyl)-2,6,10-trimethyl-7,9-tridecadien-1-ylidene]-4-hydroxy-3-methyl-, (5E)- [ACD/Index Name]
37905-12-7 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 523.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.9±3.0 kJ/mol
Flash Point: 270.3±30.1 °C
Index of Refraction: 1.568
Molar Refractivity: 118.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 8.09
ACD/LogD (pH 5.5): 6.07
ACD/BCF (pH 5.5): 13715.35
ACD/KOC (pH 5.5): 16121.88
ACD/LogD (pH 7.4): 4.31
ACD/BCF (pH 7.4): 236.60
ACD/KOC (pH 7.4): 278.11
Polar Surface Area: 60 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 362.1±3.0 cm3

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