ChemSpider 2D Image | 4-Ethoxyphenyl 3'-(trifluoromethyl)-2-biphenylcarboxylate | C22H17F3O3

4-Ethoxyphenyl 3'-(trifluoromethyl)-2-biphenylcarboxylate

  • Molecular FormulaC22H17F3O3
  • Average mass386.364 Da
  • Monoisotopic mass386.112976 Da
  • ChemSpider ID67310331

More details:

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

[1,1'-Biphenyl]-2-carboxylic acid, 3'-(trifluoromethyl)-, 4-ethoxyphenyl ester [ACD/Index Name]
3'-(Trifluorométhyl)-2-biphénylcarboxylate de 4-éthoxyphényle [French] [ACD/IUPAC Name]
4-Ethoxyphenyl 3'-(trifluoromethyl)-2-biphenylcarboxylate [ACD/IUPAC Name]
4-Ethoxyphenyl-3'-(trifluormethyl)-2-biphenylcarboxylat [German] [ACD/IUPAC 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: 495.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 244.3±23.6 °C
Index of Refraction: 1.546
Molar Refractivity: 98.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 6.67
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 32463.22
ACD/KOC (pH 5.5): 58998.13
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 32463.22
ACD/KOC (pH 7.4): 58998.13
Polar Surface Area: 36 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 312.2±3.0 cm3

Click to predict properties on the Chemicalize site


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