ChemSpider 2D Image | 2-(1,3-Benzodioxol-5-yl)-N-methyl-1-(4-methylphenyl)ethanamine | C17H19NO2

2-(1,3-Benzodioxol-5-yl)-N-methyl-1-(4-methylphenyl)ethanamine

  • Molecular FormulaC17H19NO2
  • Average mass269.338 Da
  • Monoisotopic mass269.141571 Da
  • ChemSpider ID34248817

More details:

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

1,3-Benzodioxole-5-ethanamine, N-methyl-α-(4-methylphenyl)- [ACD/Index Name]
2-(1,3-Benzodioxol-5-yl)-N-methyl-1-(4-methylphenyl)ethanamin [German] [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-N-methyl-1-(4-methylphenyl)ethanamine [ACD/IUPAC Name]
2-(1,3-Benzodioxol-5-yl)-N-méthyl-1-(4-méthylphényl)éthanamine [French] [ACD/IUPAC 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: 375.0±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 158.3±8.7 °C
Index of Refraction: 1.587
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.41
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 3.65
ACD/KOC (pH 7.4): 22.52
Polar Surface Area: 30 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 236.5±3.0 cm3

Click to predict properties on the Chemicalize site


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