2-Hydroxy-5-trifluoromethylbenzonitrile

General procedure: Methyl 2-(bromomethyl)thiophene-3-carboxylate 1a or 1b, 5 mmol, was dissolved in 15 mL of anhydrous DMF, 5 mmol of nitrile 2a-2e and 1.38 g (10 mmol) of potassium carbonate were added, and the mixture was stirred for 2 h at 55-60 C. The solvent was removed under reduced pressure, the residue was treated with 20 mL of water, and the precipitate was filtered off, washed with 10 mL of water, dried, and recrystallized from ethanol.23 g of 5-trifluoromethyl-2-hydroxybenzaldehyde oxime was added to 190 ml of acetic anhydride, and the mixture was stirred under reflux for 2 hours, concentrated, and the residue was poured into ice water. Drying, concentration and column separation gave 16 g of To a solution of 15 g of

Molecular Weight:187.12
XLogP3:2.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Exact Mass:187.02449824
Monoisotopic Mass:187.02449824
Topological Polar Surface Area:44
Heavy Atom Count:13
Complexity:229
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes