ChemSpider 2D Image | 3,4-Ethylenedioxy-N-methylamphetamine | C12H17NO2

3,4-Ethylenedioxy-N-methylamphetamine

  • Molecular FormulaC12H17NO2
  • Average mass207.269 Da
  • Monoisotopic mass207.125931 Da
  • ChemSpider ID23553090

More details:






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

3,4-Ethylenedioxy-N-methylamphetamine
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-methyl-2-propanamin [German] [ACD/IUPAC Name]
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-methyl-2-propanamine [ACD/IUPAC Name]
1-(2,3-Dihydro-1,4-benzodioxin-6-yl)-N-méthyl-2-propanamine [French] [ACD/IUPAC Name]
1,4-Benzodioxin-6-ethanamine, 2,3-dihydro-N,α-dimethyl- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 305.2±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.6±3.0 kJ/mol
Flash Point: 124.1±11.5 °C
Index of Refraction: 1.526
Molar Refractivity: 59.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 30 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 193.4±3.0 cm3

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