ChemSpider 2D Image | 1-(2-Isopropoxyethoxy)-3-[{1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl}(methyl)amino]-2-propanol | C21H37NO6

1-(2-Isopropoxyethoxy)-3-[{1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl}(methyl)amino]-2-propanol

  • Molecular FormulaC21H37NO6
  • Average mass399.522 Da
  • Monoisotopic mass399.262085 Da
  • ChemSpider ID64891897

More details:

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

1-(2-Isopropoxyethoxy)-3-[{1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl}(methyl)amino]-2-propanol [German] [ACD/IUPAC Name]
1-(2-Isopropoxyethoxy)-3-[{1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl}(methyl)amino]-2-propanol [ACD/IUPAC Name]
1-(2-Isopropoxyéthoxy)-3-[{1-[3-méthoxy-4-(2-méthoxyéthoxy)phényl]éthyl}(méthyl)amino]-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-[[1-[3-methoxy-4-(2-methoxyethoxy)phenyl]ethyl]methylamino]-3-[2-(1-methylethoxy)ethoxy]- [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: 493.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 252.4±28.7 °C
Index of Refraction: 1.498
Molar Refractivity: 110.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): -0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.23
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 6.03
ACD/KOC (pH 7.4): 97.43
Polar Surface Area: 70 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 377.2±3.0 cm3

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