ChemSpider 2D Image | 2-(4,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-methylethanamine | C12H17NO4

2-(4,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-methylethanamine

  • Molecular FormulaC12H17NO4
  • Average mass239.268 Da
  • Monoisotopic mass239.115753 Da
  • ChemSpider ID62914189

More details:






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

1,3-Benzodioxole-5-ethanamine, 4,7-dimethoxy-N-methyl- [ACD/Index Name]
2-(4,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-methylethanamin [German] [ACD/IUPAC Name]
2-(4,7-Dimethoxy-1,3-benzodioxol-5-yl)-N-methylethanamine [ACD/IUPAC Name]
2-(4,7-Diméthoxy-1,3-benzodioxol-5-yl)-N-méthyléthanamine [French] [ACD/IUPAC Name]
33543-08-7 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 338.4±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.2±3.0 kJ/mol
Flash Point: 138.4±16.0 °C
Index of Refraction: 1.527
Molar Refractivity: 63.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.84
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 206.8±3.0 cm3

Click to predict properties on the Chemicalize site






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