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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 455245Generated: October 29, 2026

Bromine → HCID 86644709, compound

https://huagongshe.com/reaction/455245

Reaction equation

Participants

RoleNameHCIDCharge
ReactantBromineHCID 24408—
ReactantPotassium thiocyanateHCID 516872—
ReactantHCID 66810289HCID 66810289—
SolventAcetic AcidHCID 176—
ProductHCID 86644709HCID 8664470988%

Reaction Steps

To a solution of methyl 5-amino-2-[4-fluoro-3-({[3-(trifluoromethyl)phenyl]acetyl}amino)phenoxy]benzoate (3.00 g, 6.09 mmol) in acetic acid (70 mL) was added potassium thiocyanate (2.37 g, 24.4 mmol), and the mixture was stirred at room temperature for 10 min. A solution of bromine (1.27 mg, 7.92 mmol) in acetic acid (35 mL) was added dropwise to the obtained solution over 20 min. After the completion of the dropwise addition, the mixture was stirred at room temperature for 36 hr. Insoluble material was filtered off and washed with ethyl acetate (200 mL). The filtrate and washings were combined and the mixture was concentrated under reduced pressure. The obtained residue was suspended in ethyl acetate (100 mL), and the suspension was washed successively with saturated aqueous sodium hydrogen carbonate solution (2×100 mL) and saturated brine (100 mL), and dried over anhydrous magnesium sulfate. Insoluble material was filtered off, the filtrate was purified by basic silica gel column chromatography (eluate: ethyl acetate), and the obtained solution was concentrated under reduced pressure. The obtained residue was recrystallized from ethyl acetate/n-hexane (1:1) to give the title compound (2.78 g, 88%) as a white powder.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08497274B2
Source datasetuspto-grants-2013_07
ORD IDord-22e790ac9f6a44b0b1bbb0ce639af336
Source noteuspto-grants-2013_07