ChemSpider 2D Image | 2-(2,5-Dimethoxy-4-methylphenyl)-N-{2-[(~2~H_3_)methyloxy]benzyl}ethanamine | C19H22D3NO3

2-(2,5-Dimethoxy-4-methylphenyl)-N-{2-[(2H3)methyloxy]benzyl}ethanamine

  • Molecular FormulaC19H22D3NO3
  • Average mass318.425 Da
  • Monoisotopic mass318.202271 Da
  • ChemSpider ID58779610

  • Non-standard isotope - Non-standard isotope

More details:

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

2-(2,5-Dimethoxy-4-methylphenyl)-N-{2-[(2H3)methyloxy]benzyl}ethanamin [German] [ACD/IUPAC Name]
2-(2,5-Dimethoxy-4-methylphenyl)-N-{2-[(2H3)methyloxy]benzyl}ethanamine [ACD/IUPAC Name]
2-(2,5-Diméthoxy-4-méthylphényl)-N-{2-[(2H3)méthyloxy]benzyl}éthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2,5-dimethoxy-4-methyl-N-[[2-(methyl-d3-oxy)phenyl]methyl]- [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: 439.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 189.2±16.8 °C
Index of Refraction: 1.542
Molar Refractivity: 93.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.83
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.45
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 7.10
ACD/KOC (pH 7.4): 46.26
Polar Surface Area: 40 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 37.0±3.0 dyne/cm
Molar Volume: 296.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement