ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2,2-trifluoroethanamine | C12H16F3NO2

N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2,2-trifluoroethanamine

  • Molecular FormulaC12H16F3NO2
  • Average mass263.256 Da
  • Monoisotopic mass263.113312 Da
  • ChemSpider ID21917662

More details:






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

Benzeneethanamine, 3,4-dimethoxy-N-(2,2,2-trifluoroethyl)- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2,2-trifluorethanamin [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,2,2-trifluoroethanamine [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-2,2,2-trifluoroéthanamine [French] [ACD/IUPAC Name]
[2-(3,4-dimethoxyphenyl)ethyl](2,2,2-trifluoroethyl)amine
[2-(3,4-Dimethoxy-phenyl)-ethyl]-(2,2,2-trifluoro-ethyl)-amine
74074-77-4 [RN]
MFCD09996823 [MDL number]
N-(3,4-dimethoxyphenethyl)-2,2,2-trifluoroethanamine
VS-10663

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

Density: 1.2±0.1 g/cm3
Boiling Point: 288.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.7±3.0 kJ/mol
Flash Point: 128.0±27.3 °C
Index of Refraction: 1.459
Molar Refractivity: 62.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 21.45
ACD/KOC (pH 5.5): 288.94
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 28.10
ACD/KOC (pH 7.4): 378.51
Polar Surface Area: 30 Å2
Polarizability: 24.8±0.5 10-24cm3
Surface Tension: 28.6±3.0 dyne/cm
Molar Volume: 228.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement