ChemSpider 2D Image | 1-(1,3-Benzodioxol-4-yl)-N,N-dimethyl-2-propanamine | C12H17NO2

1-(1,3-Benzodioxol-4-yl)-N,N-dimethyl-2-propanamine

  • Molecular FormulaC12H17NO2
  • Average mass207.269 Da
  • Monoisotopic mass207.125931 Da
  • ChemSpider ID23254904

More details:

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

1-(1,3-Benzodioxol-4-yl)-N,N-dimethyl-2-propanamin [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-4-yl)-N,N-dimethyl-2-propanamine [ACD/IUPAC Name]
1-(1,3-Benzodioxol-4-yl)-N,N-diméthyl-2-propanamine [French] [ACD/IUPAC Name]
1-(1,3-benzodioxol-4-yl)-N,N-dimethylpropan-2-amine
1,3-Benzodioxole-4-ethanamine, N,N,α-trimethyl- [ACD/Index Name]
amphetamine, 2,3-methylenedioxy-N,N-dimethyl-

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

Density: 1.1±0.1 g/cm3
Boiling Point: 289.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.8±3.0 kJ/mol
Flash Point: 101.4±12.9 °C
Index of Refraction: 1.537
Molar Refractivity: 59.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.35
ACD/LogD (pH 5.5): -0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.96
Polar Surface Area: 22 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 190.6±3.0 cm3

Click to predict properties on the Chemicalize site


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