ChemSpider 2D Image | 2-(4-Methoxy-1,3-benzodioxol-5-yl)-N-methylethanamine | C11H15NO3

2-(4-Methoxy-1,3-benzodioxol-5-yl)-N-methylethanamine

  • Molecular FormulaC11H15NO3
  • Average mass209.242 Da
  • Monoisotopic mass209.105194 Da
  • ChemSpider ID44806836

More details:






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

1,3-Benzodioxole-5-ethanamine, 4-methoxy-N-methyl- [ACD/Index Name]
2-(4-Methoxy-1,3-benzodioxol-5-yl)-N-methylethanamin [German] [ACD/IUPAC Name]
2-(4-Methoxy-1,3-benzodioxol-5-yl)-N-methylethanamine [ACD/IUPAC Name]
2-(4-Méthoxy-1,3-benzodioxol-5-yl)-N-méthyléthanamine [French] [ACD/IUPAC Name]
33543-06-5 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 298.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.9±3.0 kJ/mol
Flash Point: 120.0±15.4 °C
Index of Refraction: 1.535
Molar Refractivity: 56.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -1.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.90
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 40 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 182.8±3.0 cm3

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