ChemSpider 2D Image | 5-([(4-Butoxyphenyl)amino]{2-heptanyl[4-(2-methyl-2-propanyl)benzyl]amino}methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione | C35H50N2O5

5-([(4-Butoxyphenyl)amino]{2-heptanyl[4-(2-methyl-2-propanyl)benzyl]amino}methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione

  • Molecular FormulaC35H50N2O5
  • Average mass578.782 Da
  • Monoisotopic mass578.371948 Da
  • ChemSpider ID14258859

More details:

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

1,3-Dioxane-4,6-dione, 5-[[(4-butoxyphenyl)amino][[[4-(1,1-dimethylethyl)phenyl]methyl](1-methylhexyl)amino]methylene]-2,2-dimethyl- [ACD/Index Name]
5-([(4-Butoxyphenyl)amino]{2-heptanyl[4-(2-methyl-2-propanyl)benzyl]amino}methylen)-2,2-dimethyl-1,3-dioxan-4,6-dion [German] [ACD/IUPAC Name]
5-([(4-Butoxyphenyl)amino]{2-heptanyl[4-(2-methyl-2-propanyl)benzyl]amino}methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione [ACD/IUPAC Name]
5-([(4-Butoxyphényl)amino]{2-heptanyl[4-(2-méthyl-2-propanyl)benzyl]amino}méthylène)-2,2-diméthyl-1,3-dioxane-4,6-dione [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: 682.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.0±3.0 kJ/mol
Flash Point: 366.2±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 168.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 8.51
ACD/LogD (pH 5.5): 8.37
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 852453.56
ACD/LogD (pH 7.4): 8.37
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 852818.69
Polar Surface Area: 77 Å2
Polarizability: 66.9±0.5 10-24cm3
Surface Tension: 42.6±3.0 dyne/cm
Molar Volume: 533.3±3.0 cm3

Click to predict properties on the Chemicalize site


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