HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1910893Generated: October 31, 2026
Methyl pyrrole-2-carboxylate → methyl 1-{2-[4-(difluoromethoxy)phenyl]-2-oxoethyl)-1H-pyrrole-2-carboxylate
https://huagongshe.com/reaction/1910893
Participants
| Role | Name | HCID | Charge |
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| Reactant | Methyl pyrrole-2-carboxylate | HCID 136930 | — |
| Reactant | 2-Bromo-1-(4-(difluoromethoxy)phenyl)ethan-1-one | HCID 703496 | — |
| Reactant | Potassium tert-butoxide | HCID 23665647 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | methyl 1-{2-[4-(difluoromethoxy)phenyl]-2-oxoethyl)-1H-pyrrole-2-carboxylate | HCID 67366944 | 38% |
Reaction Steps
Potassium tert-butoxide (430 mg, 3.82 mmol) was added to a solution of methyl 1H-pyrrole-2-carboxylate (435 mg, 3.48 mmol), and 2-bromo-1-[4-(difluoromethoxy)phenyl]ethanone (1.01 g, 3.82 mmol) in DMF (7.5 mL) at 0° C., the resulting red suspension was stirred from 0° C. to room temperature for 18 h. The reaction mixture was diluted with EtOAc (30 mL) and water (10 mL). The organic layers were then separated and washed with further water (10 mL), dried (MgSO4) filtered and concentrated in vacuo to give an orange residue. The residue was purified by flash column chromatography (Biotage SP4, 40 g cartridge, 10%-20% EtOAc gradient in n-hexanes) to give methyl 1-{2-[4-(difluoromethoxy)phenyl]-2-oxoethyl}-1H-pyrrole-2-carboxylate as a yellow gum, (417 mg, yield 38%). 1H NMR (400 MHz, CDCl3): δ 3.69 (s, 3H), 5.69 (s, 2H), 6.23 (dd, 1H, J 4.0, 2.6 Hz), 6.60 (t, 1H, J 73.0 Hz), 6.82 (dd, 1H, J 2.5, 1.9 Hz), 7.03 (dd, 1H, J 4.0, 1.8 Hz), 7.19 (d, 2H, J 8.8 Hz), 7.97-8.03 (m, 2H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08604034B2 |
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| Source dataset | uspto-grants-2013_12 |
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| ORD ID | ord-d7457b60db9542ce89885d8c906c0a52 |
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| Source note | uspto-grants-2013_12 |
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