Chemical Properties of Benzophenone, 4-(trifluoromethyl)- (CAS 728-86-9)

Benzophenone, 4-(trifluoromethyl)-

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InChI
InChI=1S/C14H9F3O/c15-14(16,17)12-8-6-11(7-9-12)13(18)10-4-2-1-3-5-10/h1-9H
InChI Key
OHTYZZYAMUVKQS-UHFFFAOYSA-N
Formula
C14H9F3O
SMILES
O=C(c1ccccc1)c1ccc(C(F)(F)F)cc1
Molecular Weight1
250.22
CAS
728-86-9
Other Names
  • Benzophenone, 4-(trifluoromethyl)-
  • Methanone, phenyl[4-(trifluoromethyl)phenyl]-
  • p-Trifluoromethylbenzophenone
Sources

Physical Properties

Property Value Unit Source
EA 1.07 ± 0.09 eV NIST
Δf -428.32 kJ/mol Joback Calculated Property
Δfgas -580.36 kJ/mol Joback Calculated Property
Δfus 23.13 kJ/mol Joback Calculated Property
Δvap 54.97 kJ/mol Joback Calculated Property
logPoct/wat 3.94 Crippen Calculated Property
Pc 2581.96 kPa Joback Calculated Property
Tboil 626.51 K Joback Calculated Property
Tc 853.58 K Joback Calculated Property
Tfus 367.02 K Joback Calculated Property
Vc 0.65 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 417.80 J/mol×K 626.51 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 3
-F 3
>C< 1
>C=O (nonring) 1
=CH- (ring) 9

Similar Compounds

3,4'-Di(trifluoromethyl)benzophenone. Methanone, (4-methylphenyl)phenyl-. 4,4'-Dimethylbenzophenone. Methanone, 1,4-phenylenebis[phenyl-. 3-(Trifluoromethyl)benzophenone. 3,5-bis(trifluoromethyl)benzophenone. 3,3',5,5'-Tetrakis(trifluoromethyl)benzophenone. 4-Cyanobenzophenone. Benzophenone. p-CF3C6H4CHO. Methanone, [4-(1-methylethyl)phenyl]phenyl-. Benzhydrol, 4-trifluoromethyl-,. 4-tert-Butyl-benzophenone. 3,4-Dimethylbenzophenone. 2-Hydroxy-4'-trifluoromethyl-4-methoxybenzophenone.

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