ChemSpider 2D Image | 1-[2-Methoxy-5-(trifluoromethoxy)phenyl]-2-propanamine | C11H14F3NO2

1-[2-Methoxy-5-(trifluoromethoxy)phenyl]-2-propanamine

  • Molecular FormulaC11H14F3NO2
  • Average mass249.230 Da
  • Monoisotopic mass249.097656 Da
  • ChemSpider ID26495619

More details:






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

1-[2-Methoxy-5-(trifluormethoxy)phenyl]-2-propanamin [German] [ACD/IUPAC Name]
1-[2-Methoxy-5-(trifluoromethoxy)phenyl]-2-propanamine [ACD/IUPAC Name]
1-[2-Méthoxy-5-(trifluorométhoxy)phényl]-2-propanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 2-methoxy-α-methyl-5-(trifluoromethoxy)- [ACD/Index Name]
1-[2-methoxy-5-(trifluoromethoxy)phenyl]propan-2-amine
MFCD08453368

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

Density: 1.2±0.1 g/cm3
Boiling Point: 265.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.3±3.0 kJ/mol
Flash Point: 114.1±25.9 °C
Index of Refraction: 1.469
Molar Refractivity: 57.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): -0.76
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.22
Polar Surface Area: 44 Å2
Polarizability: 22.9±0.5 10-24cm3
Surface Tension: 30.5±3.0 dyne/cm
Molar Volume: 207.2±3.0 cm3

Click to predict properties on the Chemicalize site






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