ChemSpider 2D Image | Ethyl O-(trifluoromethyl)-L-serinate | C6H10F3NO3

Ethyl O-(trifluoromethyl)-L-serinate

  • Molecular FormulaC6H10F3NO3
  • Average mass201.144 Da
  • Monoisotopic mass201.061279 Da
  • ChemSpider ID53925628

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Ethyl O-(trifluoromethyl)-L-serinate [ACD/IUPAC Name]
Ethyl-O-(trifluormethyl)-L-serinat [German] [ACD/IUPAC Name]
L-Serine, O-(trifluoromethyl)-, ethyl ester [ACD/Index Name]
O-(Trifluorométhyl)-L-sérinate d'éthyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 189.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.6±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.6±3.0 kJ/mol
Flash Point: 68.7±25.9 °C
Index of Refraction: 1.389
Molar Refractivity: 37.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.44
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 3.59
ACD/KOC (pH 5.5): 82.87
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 4.22
ACD/KOC (pH 7.4): 97.50
Polar Surface Area: 62 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 28.7±3.0 dyne/cm
Molar Volume: 157.9±3.0 cm3

Click to predict properties on the Chemicalize site


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