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Search term: RKBWAFRQRHUEFO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2,2,2-Trifluoro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]ethanamine | C11H13F4NO

2,2,2-Trifluoro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]ethanamine

  • Molecular FormulaC11H13F4NO
  • Average mass251.221 Da
  • Monoisotopic mass251.093323 Da
  • ChemSpider ID24014068

More details:

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

2,2,2-Trifluor-N-[1-(3-fluor-4-methoxyphenyl)ethyl]ethanamin [German] [ACD/IUPAC Name]
2,2,2-Trifluoro-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]ethanamine [ACD/IUPAC Name]
2,2,2-Trifluoro-N-[1-(3-fluoro-4-méthoxyphényl)éthyl]éthanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, 3-fluoro-4-methoxy-α-methyl-N-(2,2,2-trifluoroethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 245.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.2±3.0 kJ/mol
Flash Point: 102.2±27.3 °C
Index of Refraction: 1.446
Molar Refractivity: 55.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 2.66
ACD/BCF (pH 5.5): 61.26
ACD/KOC (pH 5.5): 659.17
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 62.20
ACD/KOC (pH 7.4): 669.23
Polar Surface Area: 21 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 27.0±3.0 dyne/cm
Molar Volume: 209.4±3.0 cm3

Click to predict properties on the Chemicalize site


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