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The molecular formula of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is C9H6F4O.
The molecular weight of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is 206.14 g/mol.
The IUPAC name of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is 1-[2-fluoro-6-(trifluoromethyl)phenyl]ethanone.
The InChI of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is InChI=1S/C9H6F4O/c1-5(14)8-6(9(11,12)13)3-2-4-7(8)10/h2-4H,1H3.
The InChIKey of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is IYMYYQMPOBPRPU-UHFFFAOYSA-N.
The Canonical SMILES of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is CC(=O)C1=C(C=CC=C1F)C(F)(F)F.
The CAS number of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is 174013-29-7.
The European Community (EC) number of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is 623-199-1.
The XLogP3-AA value of 2'-Fluoro-6'-(trifluoromethyl)acetophenone is 2.6.
Yes, 2'-Fluoro-6'-(trifluoromethyl)acetophenone is a canonicalized compound.
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