HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 74001Generated: October 25, 2026
Methyl chlorodifluoroacetate → 1-Tert-butyl-2-(benzyloxy)-5-(trifluoromethyl)-4-nitrobenzene
https://huagongshe.com/reaction/74001
Participants
| Role | Name | HCID | Charge |
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| Reactant | Methyl chlorodifluoroacetate | HCID 73935 | — |
| Reactant | Potassium Bromide | HCID 253877 | — |
| Reactant | Potassium Fluoride | HCID 522689 | — |
| Reactant | 1-Tert-butyl-2-(benzyloxy)-5-bromo-4-nitrobenzene | HCID 57470237 | — |
| Catalyst | Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI) | HCID 24350 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | 1-Tert-butyl-2-(benzyloxy)-5-(trifluoromethyl)-4-nitrobenzene | HCID 57470238 | 67% |
Reaction Steps
A mixture of 1-tert-butyl-2-(benzyloxy)-5-bromo-4-nitrobenzene (913 mg, 2.5 mmol), KF (291 mg, 5 mmol), KBr (595 mg, 5 mmol), CuI (570 mg, 3 mmol), methyl chlorodifluoroacetate (1.6 mL, 15 mmol) and DMF (5 mL) was stirred at 125° C. in a sealed tube overnight, cooled to room temperature, diluted with water and extracted three times with EtOAc. The combined organic layers were washed with brine and dried over anhydrous MgSO4. After removal of the solvent, the residue was purified by column chromatography (0-5% EtOAc-Hexane) to yield 1-tert-butyl-2-(benzyloxy)-5-(trifluoromethyl)-4-nitrobenzene (591 mg, 67%). 1H NMR (400 MHz, CDCl3) 7.66 (s, 1H), 7.37 (m, 5H), 7.19 (s, 1H), 5.21 (s, 2H), 1.32 (s, 9H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08829204B2 |
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| Source dataset | uspto-grants-2014_09 |
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| ORD ID | ord-0e2a8034158147ecb0e8840e9ae30b7d |
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| Source note | uspto-grants-2014_09 |
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