Chemical Properties of 3'-(Trifluoromethyl)acetophenone (CAS 349-76-8)


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InChI Key
Molecular Weight1
Other Names
  • 3-Trifluoromethylacetophenone
  • m-Trifluoromethylacetophenone
  • 3-Trifludromethylacetophenone
  • Ethanone, 1-[3-(trifluoromethyl)phenyl]-
  • 3-CF3-C6H4-COCH3
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Physical Properties

Property Value Unit Source
PAff 835.60 kJ/mol NIST
BasG 803.70 kJ/mol NIST
EA [0.66; 0.77] eV Show Hide
EA 0.77 ± 0.09 eV NIST
EA 0.66 ± 0.01 eV NIST
Δf -582.83 kJ/mol Joback Calculated Property
Δfgas -713.69 kJ/mol Joback Calculated Property
Δfus 16.14 kJ/mol Joback Calculated Property
Δvap 41.56 kJ/mol Joback Calculated Property
log10WS -3.24 Crippen Calculated Property
logPoct/wat 2.908 Crippen Calculated Property
McVol 120.790 ml/mol McGowan Calculated Property
Pc 3022.28 kPa Joback Calculated Property
Tboil 472.00 ± 1.00 K NIST
Tc 685.09 K Joback Calculated Property
Tfus 284.25 K Joback Calculated Property
Vc 0.480 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [261.80; 320.96] J/mol×K [485.43; 685.09] Show Hide
Cp,gas 261.80 J/mol×K 485.43 Joback Calculated Property
Cp,gas 273.51 J/mol×K 518.71 Joback Calculated Property
Cp,gas 284.43 J/mol×K 551.98 Joback Calculated Property
Cp,gas 294.60 J/mol×K 585.26 Joback Calculated Property
Cp,gas 304.05 J/mol×K 618.54 Joback Calculated Property
Cp,gas 312.82 J/mol×K 651.81 Joback Calculated Property
Cp,gas 320.96 J/mol×K 685.09 Joback Calculated Property

Similar Compounds

3',5'-Bis(trifluoromethyl)acetophenone. 3-Trifluoromethylbenzoylacetonitrile. 3-Trifluoromethyl-«alpha»,«alpha»,«alpha»-trifluoroacetophenone. m-Trifluoromethylpropiophenone. Ethanone, 1,1'-(1,3-phenylene)bis-. 4'-(Trifluoromethyl)acetophenone. 4-Fluoro-3-(trifluoromethyl)acetophenone. 2'-(Trifluoromethyl)acetophenone. Acetophenone, 3-trifluoroacetyl. 3-Acetylbenzonitrile. Ethanone, 1-(3-methylphenyl)-. Acetophenone-«alpha»,«alpha»,«alpha»-d3. Acetophenone. 1-Propanone, 1-[3,5-bis(trifluoromethyl)phenyl]-. p-Trifluoromethylpropiophenone.

Find more compounds similar to 3'-(Trifluoromethyl)acetophenone.


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