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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 555955Generated: November 1, 2026

Toluene → HCID 17747836, compound

https://huagongshe.com/reaction/555955

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTolueneHCID 1140—
ReactantAmmonium ChlorideHCID 25517—
ReactantN-(2-Acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamideHCID 12979270—
ReactantHCID 178418368HCID 178418368—
SolventTetrahydrofuranHCID 8028—
ProductHCID 17747836HCID 17747836—

Reaction Conditions

Temperature-10 °C

Reaction Steps

Under argon and with stirring at −10° C., N-(2-acetylphenyl)-5-fluoro-1,3-dimethyl-1H-pyrazole-4-carboxamide (as a solid, 10 g, 36.3 mmol) and isobutylmagnesium chloride (as a 2 M solution in THF, 41.7 ml; 83.55 mmol) are added simultaneously and continuously to 400 ml of toluene over a period of 150 minutes. The mixture is allowed to warm to room temperature, 200 ml of ammonium chloride solution are added, the mixture is extracted three times with in each case 100 ml of ethyl acetate and the organic phases are dried using sodium sulphate and concentrated under reduced pressure. This gives 5-fluoro-N-[2-(1-hydroxy-1,3-dimethylbutyl)phenyl]-1,3-dimethyl-1H-pyrazole-4-carboxamide (14.2 g, purity (GC/MS) 72.8%; 85% of theory) which still contains 14% of starting material.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08053572B2
Source datasetuspto-grants-2011_11
ORD IDord-897fadea5e0d4a708ea81576f4d35820
Source noteuspto-grants-2011_11