HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 872082Generated: October 30, 2026
4-Chloro-3,5-dinitrobenzotrifluoride → HCID 59293622, compound
https://huagongshe.com/reaction/872082
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 4-Chloro-3,5-dinitrobenzotrifluoride | HCID 9809 | — |
| Reactant | tert-Butyl (3R)-3-hydroxypyrrolidine-1-carboxylate | HCID 6544479 | — |
| Reactant | Potassium tert-butoxide | HCID 23665647 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Solvent | tert-Butyl methyl ether | HCID 15413 | — |
| Product | HCID 59293622 | HCID 59293622 | — |
Reaction Steps
(R)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester (compound 20) is de-protonated with potassium tert-butoxide (KOtBu) in tetrahydrofuran (THF). The resulting anion is reacted 2-chloro-1,3-dinitro-5-trifluoromethylbenzene (compound 2) in tert-butyl methyl ether (MTBE)/THF. When the reaction is complete, the reaction mixture is quenched with water and partitioned with more MTBE. The organic layer is washed with brine and water and concentrated on a rotary evaporator. The solid concentrate is re-dissolved in methanol and re-precipitated with water. The resulting precipitate is filtered and dried to afford (R)-3-(2,6-dinitro-4-trifluoromethylphenoxy)pyrrolidine-1-carboxylic acid tert-butyl ester which can be used in the next step without further purification. This reaction has been carried out at a scale using 4.2 Kg of compound 2.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08975262B2 |
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| Source dataset | uspto-grants-2015_03 |
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| ORD ID | ord-b8da7f2644fb4b6c9ba949de09cda57c |
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| Source note | uspto-grants-2015_03 |
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