ChemSpider 2D Image | (2S)-1-(2,5-Dimethoxy-4-methylphenyl)-N-methyl-2-propanamine | C13H21NO2

(2S)-1-(2,5-Dimethoxy-4-methylphenyl)-N-methyl-2-propanamine

  • Molecular FormulaC13H21NO2
  • Average mass223.311 Da
  • Monoisotopic mass223.157227 Da
  • ChemSpider ID129165863

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(2,5-Dimethoxy-4-methylphenyl)-N-methyl-2-propanamin [German] [ACD/IUPAC Name]
(2S)-1-(2,5-Dimethoxy-4-methylphenyl)-N-methyl-2-propanamine [ACD/IUPAC Name]
(2S)-1-(2,5-Diméthoxy-4-méthylphényl)-N-méthyl-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2,5-dimethoxy-N,α,4-trimethyl-, (αS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 316.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 133.4±16.0 °C
Index of Refraction: 1.496
Molar Refractivity: 66.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.29
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.40
Polar Surface Area: 30 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 31.0±3.0 dyne/cm
Molar Volume: 228.7±3.0 cm3

Click to predict properties on the Chemicalize site


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