HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1044009Generated: October 26, 2026
1-Butyne → Tert-butyl 4-(but-1-ynyl)-6-chloropyridin-3-ylcarbamate
https://huagongshe.com/reaction/1044009
Participants
| Role | Name | HCID | Charge |
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| Reactant | 1-Butyne | HCID 7846 | — |
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | tert-Butyl (6-chloro-4-iodopyridin-3-yl)carbamate | HCID 53415320 | — |
| Catalyst | Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI) | HCID 24350 | — |
| Catalyst | HCID 178418476 | HCID 178418476 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | Tert-butyl 4-(but-1-ynyl)-6-chloropyridin-3-ylcarbamate | HCID 57908177 | 74% |
Reaction Steps
To a deoxygenated solution of (6-chloro-4-iodo-pyridin-3-yl)-carbamic acid tert-butyl ester (6.0 g, 16.9 mmol), 1-butyne (9 g, 169 mmol), CuI (160.1 mg, 0.84 mmol) and triethylamine (3.4 g, 33.2 mmol) in toluene (40 mL) and water (14 mL) was added Pd(PPh3)2Cl2 (592 mg, 0.84 mmol) under N2 in a autoclave. The mixture was heated to 70° C. and stirred for 24 h. The solid was filtered off and washed with ethyl acetate (60 mL×3). The filtrate was evaporated under reduced pressure and the residue was purified by column chromatography on silica gel (petroleum ether/ethyl acetate, 10/1) to give tert-butyl 4-(but-1-ynyl)-6-chloropyridin-3-ylcarbamate (3.5 g, 74%). 1H-NMR (CDCl3, 300 MHz) δ 9.13 (s, 1H), 7.22 (s, 1H), 6.98 (s, 1H), 2.53 (q, J=7.5 Hz, 2H), 1.54 (s, 9H), 1.29 (t, J=7.5 Hz, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08563573B2 |
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| Source dataset | uspto-grants-2013_10 |
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| ORD ID | ord-f4707b633fec46d096ccd5682e4dda22 |
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| Source note | uspto-grants-2013_10 |
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