ChemSpider 2D Image | (2R)-1-(1,3-Benzodioxol-5-yl)-N-isopropyl-2-propanamine | C13H19NO2

(2R)-1-(1,3-Benzodioxol-5-yl)-N-isopropyl-2-propanamine

  • Molecular FormulaC13H19NO2
  • Average mass221.296 Da
  • Monoisotopic mass221.141586 Da
  • ChemSpider ID57465369

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-1-(1,3-Benzodioxol-5-yl)-N-isopropyl-2-propanamin [German] [ACD/IUPAC Name]
(2R)-1-(1,3-Benzodioxol-5-yl)-N-isopropyl-2-propanamine [ACD/IUPAC Name]
(2R)-1-(1,3-Benzodioxol-5-yl)-N-isopropyl-2-propanamine [French] [ACD/IUPAC Name]
1,3-Benzodioxole-5-ethanamine, α-methyl-N-(1-methylethyl)-, (αR)- [ACD/Index Name]
3,4-methylenedioxy-N-isopropylamphetamine [Wiki]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 310.0±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 128.7±8.7 °C
Index of Refraction: 1.525
Molar Refractivity: 64.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): -0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.23
Polar Surface Area: 30 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 209.0±3.0 cm3

Click to predict properties on the Chemicalize site


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