ChemSpider 2D Image | N-{3-Ethoxy-4-[(4-methylbenzyl)oxy]benzyl}-3,5-dimethyl-1-adamantanamine | C29H39NO2

N-{3-Ethoxy-4-[(4-methylbenzyl)oxy]benzyl}-3,5-dimethyl-1-adamantanamine

  • Molecular FormulaC29H39NO2
  • Average mass433.625 Da
  • Monoisotopic mass433.298065 Da
  • ChemSpider ID21536406

More details:

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

N-{3-Ethoxy-4-[(4-methylbenzyl)oxy]benzyl}-3,5-dimethyl-1-adamantanamin [German] [ACD/IUPAC Name]
N-{3-Ethoxy-4-[(4-methylbenzyl)oxy]benzyl}-3,5-dimethyl-1-adamantanamine [ACD/IUPAC Name]
N-{3-Éthoxy-4-[(4-méthylbenzyl)oxy]benzyl}-3,5-diméthyl-1-adamantanamine [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decan-1-amine, N-[[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]-3,5-dimethyl- [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: 535.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 240.5±18.2 °C
Index of Refraction: 1.587
Molar Refractivity: 131.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 7.74
ACD/LogD (pH 5.5): 4.01
ACD/BCF (pH 5.5): 118.75
ACD/KOC (pH 5.5): 141.74
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 552.83
ACD/KOC (pH 7.4): 659.86
Polar Surface Area: 30 Å2
Polarizability: 52.0±0.5 10-24cm3
Surface Tension: 46.6±5.0 dyne/cm
Molar Volume: 390.5±5.0 cm3

Click to predict properties on the Chemicalize site


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