ChemSpider 2D Image | 2-(4-Chlorophenyl)-2-oxoethyl 3-(trifluoromethyl)benzoate | C16H10ClF3O3

2-(4-Chlorophenyl)-2-oxoethyl 3-(trifluoromethyl)benzoate

  • Molecular FormulaC16H10ClF3O3
  • Average mass342.697 Da
  • Monoisotopic mass342.027069 Da
  • ChemSpider ID30656779

More details:

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

2-(4-Chlorophenyl)-2-oxoethyl 3-(trifluoromethyl)benzoate [ACD/IUPAC Name]
2-(4-Chlorphenyl)-2-oxoethyl-3-(trifluormethyl)benzoat [German] [ACD/IUPAC Name]
3-(Trifluorométhyl)benzoate de 2-(4-chlorophényl)-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-(trifluoromethyl)-, 2-(4-chlorophenyl)-2-oxoethyl ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 459.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 187.7±17.9 °C
Index of Refraction: 1.536
Molar Refractivity: 77.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 4.91
ACD/BCF (pH 5.5): 3198.00
ACD/KOC (pH 5.5): 11230.17
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 3198.00
ACD/KOC (pH 7.4): 11230.17
Polar Surface Area: 43 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 40.1±3.0 dyne/cm
Molar Volume: 248.7±3.0 cm3

Click to predict properties on the Chemicalize site


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