ChemSpider 2D Image | (2E)-1,1,1-Trifluoro-4-oxo-4-phenyl-2-buten-2-yl acetate | C12H9F3O3

(2E)-1,1,1-Trifluoro-4-oxo-4-phenyl-2-buten-2-yl acetate

  • Molecular FormulaC12H9F3O3
  • Average mass258.193 Da
  • Monoisotopic mass258.050385 Da
  • ChemSpider ID30686795

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-1,1,1-Trifluor-4-oxo-4-phenyl-2-buten-2-yl-acetat [German] [ACD/IUPAC Name]
(2E)-1,1,1-Trifluoro-4-oxo-4-phenyl-2-buten-2-yl acetate [ACD/IUPAC Name]
2-Buten-1-one, 3-(acetyloxy)-4,4,4-trifluoro-1-phenyl-, (2E)- [ACD/Index Name]
Acétate de (2E)-1,1,1-trifluoro-4-oxo-4-phényl-2-butén-2-yle [French] [ACD/IUPAC Name]
(1,1,1-Trifluoro-4-oxo-4-phenylbut-2-en-2-yl) acetate
149172-65-6 [RN]
1-benzoyl-2-trifluoromethyl-2-acetoxyethene

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

Density: 1.3±0.1 g/cm3
Boiling Point: 297.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.7±3.0 kJ/mol
Flash Point: 129.6±22.2 °C
Index of Refraction: 1.480
Molar Refractivity: 56.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 261.64
ACD/KOC (pH 5.5): 1871.52
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 261.64
ACD/KOC (pH 7.4): 1871.52
Polar Surface Area: 43 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 200.3±3.0 cm3

Click to predict properties on the Chemicalize site


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