ChemSpider 2D Image | 3,3,3-Trifluoro-2-(trifluoromethoxy)-2-(trifluoromethyl)propanoic acid | C5HF9O3

3,3,3-Trifluoro-2-(trifluoromethoxy)-2-(trifluoromethyl)propanoic acid

  • Molecular FormulaC5HF9O3
  • Average mass280.045 Da
  • Monoisotopic mass279.978210 Da
  • ChemSpider ID111127192

More details:

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

3,3,3-Trifluor-2-(trifluormethoxy)-2-(trifluormethyl)propansäure [German] [ACD/IUPAC Name]
3,3,3-Trifluoro-2-(trifluoromethoxy)-2-(trifluoromethyl)propanoic acid [ACD/IUPAC Name]
Acide 3,3,3-trifluoro-2-(trifluorométhoxy)-2-(trifluorométhyl)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3,3,3-trifluoro-2-(trifluoromethoxy)-2-(trifluoromethyl)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 168.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.8±0.6 mmHg at 25°C
Enthalpy of Vaporization: 44.7±6.0 kJ/mol
Flash Point: 55.9±25.9 °C
Index of Refraction: 1.297
Molar Refractivity: 29.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 8.27
ACD/LogD (pH 5.5): 1.79
ACD/BCF (pH 5.5): 1.71
ACD/KOC (pH 5.5): 4.39
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 1.70
ACD/KOC (pH 7.4): 4.37
Polar Surface Area: 47 Å2
Polarizability: 11.8±0.5 10-24cm3
Surface Tension: 19.4±3.0 dyne/cm
Molar Volume: 161.3±3.0 cm3

Click to predict properties on the Chemicalize site


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