ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-N-methyl-1-propanamine | C11H15NO2

1-(1,3-Benzodioxol-5-yl)-N-methyl-1-propanamine

  • Molecular FormulaC11H15NO2
  • Average mass193.242 Da
  • Monoisotopic mass193.110275 Da
  • ChemSpider ID37674716

More details:






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

1-(1,3-Benzodioxol-5-yl)-N-methyl-1-propanamin [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N-methyl-1-propanamine [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-N-méthyl-1-propanamine [French] [ACD/IUPAC Name]
1,3-Benzodioxole-5-methanamine, α-ethyl-N-methyl- [ACD/Index Name]
127292-43-7 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 268.0±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.6±3.0 kJ/mol
Flash Point: 107.5±13.7 °C
Index of Refraction: 1.535
Molar Refractivity: 54.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.26
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): -0.24
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.84
Polar Surface Area: 30 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 41.0±3.0 dyne/cm
Molar Volume: 176.0±3.0 cm3

Click to predict properties on the Chemicalize site






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