ChemSpider 2D Image | 2-[4-Ethoxy-3-(3-methylbutoxy)phenyl]-N,N'-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexanedicarboxamide | C38H48N2O8

2-[4-Ethoxy-3-(3-methylbutoxy)phenyl]-N,N'-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexanedicarboxamide

  • Molecular FormulaC38H48N2O8
  • Average mass660.796 Da
  • Monoisotopic mass660.341064 Da
  • ChemSpider ID12182980

More details:

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

1,3-Cyclohexanedicarboxamide, 2-[4-ethoxy-3-(3-methylbutoxy)phenyl]-N1,N3-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo- [ACD/Index Name]
2-[4-Ethoxy-3-(3-methylbutoxy)phenyl]-N,N'-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexandicarboxamid [German] [ACD/IUPAC Name]
2-[4-Ethoxy-3-(3-methylbutoxy)phenyl]-N,N'-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-1,3-cyclohexanedicarboxamide [ACD/IUPAC Name]
2-[4-Éthoxy-3-(3-méthylbutoxy)phényl]-N,N'-bis(2-éthoxyphényl)-4-hydroxy-4-méthyl-6-oxo-1,3-cyclohexanedicarboxamide [French] [ACD/IUPAC Name]
2-[4-Ethoxy-3-(3-methylbutoxy)phenyl]-N,N'-bis(2-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 819.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 124.9±3.0 kJ/mol
Flash Point: 449.4±34.3 °C
Index of Refraction: 1.586
Molar Refractivity: 185.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 6.73
ACD/LogD (pH 5.5): 6.07
ACD/BCF (pH 5.5): 24194.84
ACD/KOC (pH 5.5): 47778.20
ACD/LogD (pH 7.4): 6.01
ACD/BCF (pH 7.4): 21252.53
ACD/KOC (pH 7.4): 41967.94
Polar Surface Area: 132 Å2
Polarizability: 73.4±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 551.7±3.0 cm3

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