ChemSpider 2D Image | (2E,6E)-2,6-Bis(2,5-dimethoxybenzylidene)-4-(2-methyl-2-propanyl)cyclohexanone | C28H34O5

(2E,6E)-2,6-Bis(2,5-dimethoxybenzylidene)-4-(2-methyl-2-propanyl)cyclohexanone

  • Molecular FormulaC28H34O5
  • Average mass450.567 Da
  • Monoisotopic mass450.240631 Da
  • ChemSpider ID64845090

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,6E)-2,6-Bis(2,5-dimethoxybenzyliden)-4-(2-methyl-2-propanyl)cyclohexanon [German] [ACD/IUPAC Name]
(2E,6E)-2,6-Bis(2,5-dimethoxybenzylidene)-4-(2-methyl-2-propanyl)cyclohexanone [ACD/IUPAC Name]
(2E,6E)-2,6-Bis(2,5-diméthoxybenzylidène)-4-(2-méthyl-2-propanyl)cyclohexanone [French] [ACD/IUPAC Name]
Cyclohexanone, 2,6-bis[(2,5-dimethoxyphenyl)methylene]-4-(1,1-dimethylethyl)-, (2E,6E)- [ACD/Index Name]
(2E,6E)-4-tert-butyl-2,6-bis[(2,5-dimethoxyphenyl)methylidene]cyclohexan-1-one

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

Density: 1.1±0.1 g/cm3
Boiling Point: 618.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 262.7±31.5 °C
Index of Refraction: 1.583
Molar Refractivity: 134.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 7.80
ACD/LogD (pH 5.5): 6.65
ACD/BCF (pH 5.5): 66848.97
ACD/KOC (pH 5.5): 98942.70
ACD/LogD (pH 7.4): 6.65
ACD/BCF (pH 7.4): 66848.97
ACD/KOC (pH 7.4): 98942.70
Polar Surface Area: 54 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 43.7±3.0 dyne/cm
Molar Volume: 400.8±3.0 cm3

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