ChemSpider 2D Image | 2,2'-{[4-(Allyloxy)phenyl]methylene}bis(5,5-dimethyl-1,3-cyclohexanedione) | C26H32O5

2,2'-{[4-(Allyloxy)phenyl]methylene}bis(5,5-dimethyl-1,3-cyclohexanedione)

  • Molecular FormulaC26H32O5
  • Average mass424.529 Da
  • Monoisotopic mass424.224976 Da
  • ChemSpider ID21893926

More details:

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

1,3-Cyclohexanedione, 2,2'-[[4-(2-propen-1-yloxy)phenyl]methylene]bis[5,5-dimethyl- [ACD/Index Name]
2,2'-{[4-(Allyloxy)phenyl]methylen}bis(5,5-dimethyl-1,3-cyclohexandion) [German] [ACD/IUPAC Name]
2,2'-{[4-(Allyloxy)phenyl]methylene}bis(5,5-dimethyl-1,3-cyclohexanedione) [ACD/IUPAC Name]
2,2'-{[4-(Allyloxy)phényl]méthylène}bis(5,5-diméthyl-1,3-cyclohexanedione) [French] [ACD/IUPAC 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: 589.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 87.9±3.0 kJ/mol
Flash Point: 252.3±30.2 °C
Index of Refraction: 1.531
Molar Refractivity: 117.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 38.57
ACD/KOC (pH 5.5): 245.22
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.75
Polar Surface Area: 78 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 379.4±3.0 cm3

Click to predict properties on the Chemicalize site


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