ChemSpider 2D Image | 1-{2,5-Bis[(~2~H_3_)methyloxy]phenyl}-2-propanamine | C11H11D6NO2

1-{2,5-Bis[(2H3)methyloxy]phenyl}-2-propanamine

  • Molecular FormulaC11H11D6NO2
  • Average mass201.295 Da
  • Monoisotopic mass201.163589 Da
  • ChemSpider ID48060130

  • Non-standard isotope - Non-standard isotope

More details:

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

1-{2,5-Bis[(2H3)methyloxy]phenyl}-2-propanamin [German] [ACD/IUPAC Name]
1-{2,5-Bis[(2H3)methyloxy]phenyl}-2-propanamine [ACD/IUPAC Name]
1-{2,5-Bis[(2H3)méthyloxy]phényl}-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, α-methyl-2,5-bis(methyl-d3-oxy)- [ACD/Index Name]
1021684-61-6 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 296.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.7±3.0 kJ/mol
Flash Point: 145.2±30.4 °C
Index of Refraction: 1.512
Molar Refractivity: 57.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.18
Polar Surface Area: 44 Å2
Polarizability: 22.7±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 190.8±3.0 cm3

Click to predict properties on the Chemicalize site


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