ChemSpider 2D Image | 2-(Trifluoromethoxy)-benzenepropanoic acid | C10H9F3O3

2-(Trifluoromethoxy)-benzenepropanoic acid

  • Molecular FormulaC10H9F3O3
  • Average mass234.172 Da
  • Monoisotopic mass234.050385 Da
  • ChemSpider ID21469805

More details:

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

2-(Trifluoromethoxy)-benzenepropanoic acid
3-[2-(Trifluormethoxy)phenyl]propansäure [German] [ACD/IUPAC Name]
3-[2-(Trifluoromethoxy)phenyl]propanoic acid [ACD/IUPAC Name]
914636-53-6 [RN]
Acide 3-[2-(trifluorométhoxy)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 2-(trifluoromethoxy)- [ACD/Index Name]
2-(2-Carboxyethyl)-α,α,α-trifluoroanisole
2-(Trifluoromethoxy)hydrocinnamic acid
2-(Trifluoromethoxy)hydrocinnamic acid, 2-(2-Carboxyethyl)-α,α,α-trifluoroanisole
2-(Trifluoromethoxy)hydrocinnamic acid; 2-(2-Carboxyethyl)-α,α,α-trifluoroanisole
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 265.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.2±3.0 kJ/mol
Flash Point: 114.3±25.9 °C
Index of Refraction: 1.477
Molar Refractivity: 49.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 1.80
ACD/BCF (pH 5.5): 7.97
ACD/KOC (pH 5.5): 81.47
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.28
Polar Surface Area: 47 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 173.8±3.0 cm3

Click to predict properties on the Chemicalize site


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