ChemSpider 2D Image | Methyl 2-(trifluoromethyl)-2-oxiranecarboxylate | C5H5F3O3

Methyl 2-(trifluoromethyl)-2-oxiranecarboxylate

  • Molecular FormulaC5H5F3O3
  • Average mass170.087 Da
  • Monoisotopic mass170.019073 Da
  • ChemSpider ID65009799

More details:

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

117015-39-1 [RN]
2-(Trifluorométhyl)-2-oxiranecarboxylate de méthyle [French] [ACD/IUPAC Name]
2-Oxiranecarboxylic acid, 2-(trifluoromethyl)-, methyl ester [ACD/Index Name]
Methyl 2-(trifluoromethyl)-2-oxiranecarboxylate [ACD/IUPAC Name]
methyl 2-(trifluoromethyl)oxirane-2-carboxylate
Methyl-2-(trifluormethyl)-2-oxirancarboxylat [German] [ACD/IUPAC Name]
MFCD31421392

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

Density: 1.5±0.1 g/cm3
Boiling Point: 116.7±35.0 °C at 760 mmHg
Vapour Pressure: 18.0±0.2 mmHg at 25°C
Enthalpy of Vaporization: 35.5±3.0 kJ/mol
Flash Point: 24.7±20.8 °C
Index of Refraction: 1.383
Molar Refractivity: 26.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.34
ACD/LogD (pH 5.5): 0.95
ACD/BCF (pH 5.5): 3.08
ACD/KOC (pH 5.5): 77.92
ACD/LogD (pH 7.4): 0.95
ACD/BCF (pH 7.4): 3.08
ACD/KOC (pH 7.4): 77.92
Polar Surface Area: 39 Å2
Polarizability: 10.5±0.5 10-24cm3
Surface Tension: 30.5±3.0 dyne/cm
Molar Volume: 113.4±3.0 cm3

Click to predict properties on the Chemicalize site


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