ChemSpider 2D Image | 2-(3-Fluoro-4-methoxyphenyl)-1-(2-{[3-(trifluoromethyl)phenoxy]methyl}-4-morpholinyl)ethanone | C21H21F4NO4

2-(3-Fluoro-4-methoxyphenyl)-1-(2-{[3-(trifluoromethyl)phenoxy]methyl}-4-morpholinyl)ethanone

  • Molecular FormulaC21H21F4NO4
  • Average mass427.389 Da
  • Monoisotopic mass427.140686 Da
  • ChemSpider ID22737196

More details:

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

2-(3-Fluor-4-methoxyphenyl)-1-(2-{[3-(trifluormethyl)phenoxy]methyl}-4-morpholinyl)ethanon [German] [ACD/IUPAC Name]
2-(3-Fluoro-4-methoxyphenyl)-1-(2-{[3-(trifluoromethyl)phenoxy]methyl}-4-morpholinyl)ethanone [ACD/IUPAC Name]
2-(3-Fluoro-4-méthoxyphényl)-1-(2-{[3-(trifluorométhyl)phénoxy]méthyl}-4-morpholinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(3-fluoro-4-methoxyphenyl)-1-[2-[[3-(trifluoromethyl)phenoxy]methyl]-4-morpholinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 541.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 281.5±30.1 °C
Index of Refraction: 1.514
Molar Refractivity: 99.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.20
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 490.16
ACD/KOC (pH 5.5): 2933.23
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 490.16
ACD/KOC (pH 7.4): 2933.23
Polar Surface Area: 48 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 331.7±3.0 cm3

Click to predict properties on the Chemicalize site


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