ChemSpider 2D Image | (2E,5E)-2-[(2E)-3-(2-Methoxy-5-oxo-2,5-dihydro-3-furanyl)-2-propen-1-ylidene]-6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-5-octenal | C26H36O4

(2E,5E)-2-[(2E)-3-(2-Methoxy-5-oxo-2,5-dihydro-3-furanyl)-2-propen-1-ylidene]-6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-5-octenal

  • Molecular FormulaC26H36O4
  • Average mass412.562 Da
  • Monoisotopic mass412.261353 Da
  • ChemSpider ID40256919

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,5E)-2-[(2E)-3-(2-Methoxy-5-oxo-2,5-dihydro-3-furanyl)-2-propen-1-yliden]-6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-5-octenal [German] [ACD/IUPAC Name]
(2E,5E)-2-[(2E)-3-(2-Methoxy-5-oxo-2,5-dihydro-3-furanyl)-2-propen-1-ylidene]-6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-5-octenal [ACD/IUPAC Name]
(2E,5E)-2-[(2E)-3-(2-Méthoxy-5-oxo-2,5-dihydro-3-furanyl)-2-propén-1-ylidène]-6-méthyl-8-(2,6,6-triméthyl-1-cyclohexén-1-yl)-5-octénal [French] [ACD/IUPAC Name]
5-Octenal, 2-[(2E)-3-(2,5-dihydro-2-methoxy-5-oxo-3-furanyl)-2-propen-1-ylidene]-6-methyl-8-(2,6,6-trimethyl-1-cyclohexen-1-yl)-, (2E,5E)- [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: 583.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 248.8±30.2 °C
Index of Refraction: 1.531
Molar Refractivity: 120.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8083.59
ACD/KOC (pH 5.5): 21809.89
ACD/LogD (pH 7.4): 5.44
ACD/BCF (pH 7.4): 8083.59
ACD/KOC (pH 7.4): 21809.89
Polar Surface Area: 53 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 40.0±5.0 dyne/cm
Molar Volume: 390.1±5.0 cm3

Click to predict properties on the Chemicalize site


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