ChemSpider 2D Image | 1-[3,5-Dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]-2-propanamine | C13H18F3NO3

1-[3,5-Dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]-2-propanamine

  • Molecular FormulaC13H18F3NO3
  • Average mass293.282 Da
  • Monoisotopic mass293.123871 Da
  • ChemSpider ID38642125

More details:

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

1-[3,5-Dimethoxy-4-(2,2,2-trifluorethoxy)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
1-[3,5-Dimethoxy-4-(2,2,2-trifluoroethoxy)phenyl]-2-propanamine [ACD/IUPAC Name]
1-[3,5-Diméthoxy-4-(2,2,2-trifluoroéthoxy)phényl]-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 3,5-dimethoxy-α-methyl-4-(2,2,2-trifluoroethoxy)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 326.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 151.0±27.9 °C
Index of Refraction: 1.470
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.47
Polar Surface Area: 54 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 247.7±3.0 cm3

Click to predict properties on the Chemicalize site


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