ChemSpider 2D Image | 2-Ethoxyethyl {[6-{[butyl(hexyl)amino]methyl}-1-(3-isopropoxypropyl)-4-oxo-1,4-dihydro-3-pyridinyl]oxy}acetate | C28H50N2O6

2-Ethoxyethyl {[6-{[butyl(hexyl)amino]methyl}-1-(3-isopropoxypropyl)-4-oxo-1,4-dihydro-3-pyridinyl]oxy}acetate

  • Molecular FormulaC28H50N2O6
  • Average mass510.706 Da
  • Monoisotopic mass510.366882 Da
  • ChemSpider ID123518409

More details:

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

{[6-{[Butyl(hexyl)amino]méthyl}-1-(3-isopropoxypropyl)-4-oxo-1,4-dihydro-3-pyridinyl]oxy}acétate de 2-éthoxyéthyle [French] [ACD/IUPAC Name]
2-Ethoxyethyl {[6-{[butyl(hexyl)amino]methyl}-1-(3-isopropoxypropyl)-4-oxo-1,4-dihydro-3-pyridinyl]oxy}acetate [ACD/IUPAC Name]
2-Ethoxyethyl-{[6-{[butyl(hexyl)amino]methyl}-1-(3-isopropoxypropyl)-4-oxo-1,4-dihydro-3-pyridinyl]oxy}acetat [German] [ACD/IUPAC Name]
Acetic acid, 2-[[6-[(butylhexylamino)methyl]-1,4-dihydro-1-[3-(1-methylethoxy)propyl]-4-oxo-3-pyridinyl]oxy]-, 2-ethoxyethyl ester [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: 602.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.6±3.0 kJ/mol
Flash Point: 318.0±31.5 °C
Index of Refraction: 1.505
Molar Refractivity: 144.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 2
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 1.88
ACD/BCF (pH 5.5): 2.86
ACD/KOC (pH 5.5): 9.86
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 14.47
ACD/KOC (pH 7.4): 49.88
Polar Surface Area: 78 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 485.5±5.0 cm3

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