ChemSpider 2D Image | 2-(2-Thienyl)-1-[3-(2,2,2-trifluoroethoxy)-1-azetidinyl]ethanone | C11H12F3NO2S

2-(2-Thienyl)-1-[3-(2,2,2-trifluoroethoxy)-1-azetidinyl]ethanone

  • Molecular FormulaC11H12F3NO2S
  • Average mass279.279 Da
  • Monoisotopic mass279.054077 Da
  • ChemSpider ID39182827

More details:

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

2-(2-Thienyl)-1-[3-(2,2,2-trifluorethoxy)-1-azetidinyl]ethanon [German] [ACD/IUPAC Name]
2-(2-Thienyl)-1-[3-(2,2,2-trifluoroethoxy)-1-azetidinyl]ethanone [ACD/IUPAC Name]
2-(2-Thiényl)-1-[3-(2,2,2-trifluoroéthoxy)-1-azétidinyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-(2-thienyl)-1-[3-(2,2,2-trifluoroethoxy)-1-azetidinyl]- [ACD/Index Name]
2-(thiophen-2-yl)-1-(3-(2,2,2-trifluoroethoxy)azetidin-1-yl)ethanone
2-(thiophen-2-yl)-1-[3-(2,2,2-trifluoroethoxy)azetidin-1-yl]ethan-1-one
2034249-90-4 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 380.5±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.9±3.0 kJ/mol
Flash Point: 183.9±27.9 °C
Index of Refraction: 1.517
Molar Refractivity: 61.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 17.13
ACD/KOC (pH 5.5): 265.93
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.13
ACD/KOC (pH 7.4): 265.93
Polar Surface Area: 58 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 41.1±5.0 dyne/cm
Molar Volume: 202.7±5.0 cm3

Click to predict properties on the Chemicalize site


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