ChemSpider 2D Image | 2-(4-Chlorophenyl)-3-[4-(trifluoromethyl)phenyl]propanoic acid | C16H12ClF3O2

2-(4-Chlorophenyl)-3-[4-(trifluoromethyl)phenyl]propanoic acid

  • Molecular FormulaC16H12ClF3O2
  • Average mass328.714 Da
  • Monoisotopic mass328.047791 Da
  • ChemSpider ID44896270

More details:

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

2-(4-Chlorophenyl)-3-[4-(trifluoromethyl)phenyl]propanoic acid [ACD/IUPAC Name]
2-(4-Chlorphenyl)-3-[4-(trifluormethyl)phenyl]propansäure [German] [ACD/IUPAC Name]
Acide 2-(4-chlorophényl)-3-[4-(trifluorométhyl)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, α-(4-chlorophenyl)-4-(trifluoromethyl)- [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: 381.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.5±3.0 kJ/mol
Flash Point: 184.8±26.5 °C
Index of Refraction: 1.548
Molar Refractivity: 76.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.71
ACD/LogD (pH 5.5): 3.39
ACD/BCF (pH 5.5): 93.24
ACD/KOC (pH 5.5): 322.67
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 1.80
ACD/KOC (pH 7.4): 6.22
Polar Surface Area: 37 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 240.3±3.0 cm3

Click to predict properties on the Chemicalize site


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