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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 389130Generated: October 29, 2026

Water → HCID 136352700, compound

https://huagongshe.com/reaction/389130

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantSodium methanethiolateHCID 4378561—
ReactantHCID 86653017HCID 86653017—
SolventDimethylformamideHCID 6228—
ProductHCID 136352700HCID 13635270042.6%

Reaction Conditions

Temperature100 °C

Reaction Steps

Sodium thiomethoxide (30 mg) was added to a solution of 3-[4-methoxy-2-(trifluoromethyl)phenyl]-4-methyl-5-{1-methyl-1-[4-(trifluoromethyl)phenoxy]ethyl}-4H-1,2,4-triazole monohydrochloride (87 mg) in DMF (3 ml) under a nitrogen atmosphere, followed by stirring at 100° C. for 17 hours. The reaction solution was stood to cool to room temperature, and water was added thereto, followed by extraction with ethyl acetate. The organic layer was washed with water and then saturated brine in this order and dried over anhydrous magnesium sulfate and the solvent was evaporated under reduced pressure. The residue was purified by thin layer chromatography (ethyl acetate). The resulting residue was powdered with diisopropylether, the resulting solid was dissolved in ethyl acetate (1 ml), and 4M hydrogen chloride-ethyl acetate was added thereto. The precipitated solid was collected by filtration and dried under reduced pressure to obtain, as a colorless solid, 4-(4-methyl-5-{1-methyl-1-[4-(trifluoromethyl)phenoxy]ethyl}-4H-1,2,4-triazol-3-yl)-3-(trifluoromethyl)phenol monohydrochloride (36 mg).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08377923B2
Source datasetuspto-grants-2013_02
ORD IDord-2e586b74e9404379987732818da20de7
Source noteuspto-grants-2013_02