HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1968231Generated: October 29, 2026
Iodine → 5-chloro-3-iodo-1-tosyl-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde
https://huagongshe.com/reaction/1968231
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Iodine | HCID 807 | — |
| Reactant | Sodium Iodide | HCID 5238 | — |
| Reactant | 4-Toluenesulfonyl chloride | HCID 7397 | — |
| Reactant | Sodium Hydroxide | HCID 14798 | — |
| Reactant | Sodium hydride | HCID 24758 | — |
| Reactant | 5-Chloro-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde | HCID 24229280 | — |
| Solvent | Ethanol | HCID 702 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | 5-chloro-3-iodo-1-tosyl-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde | HCID 58293441 | 70.2% |
Reaction Steps
To a solution of 5-chloro-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde (5.0 g, 27.7 mmol) in EtOH (100 mL) was added iodine (8.43 g, 33.2 mmol), sodium iodide (4.98 g, 33.2 mmol), and aqueous NaOH (1N, 35 mL, 35 mmol). After stirring for 4 h at room temperature, the reaction mixture was diluted with water (200 mL). An orange precipitate was collected by filtration and dried under vacuum. The solid was dissolved in DMF (60 mL) and sodium hydride (60%, 1.33 g, 33.2 mmol) was slowly added. The deep red solution was stirred for 30 min at room temperature. Tosyl chloride (5.81 g, 30.5 mmol) was added and the mixture was stirred at room temperature for 2 h. The mixture was diluted with EtOAc and the reaction was quenched with water. The organics were separated, washed with aqueous NaHSO3 (0.1 N) and brine, dried over MgSO4, and concentrated. Purification by silica gel chromatography (3:1:1 hexane/DCM/EtOAc) gave the title compound as a yellow solid (8.96 g, 70%). 1H NMR (500 MHz, DMSO-d6) δ 3.15 (s, 3 H), 8.24 (d, J=8.5 Hz, 2 H), 8.81 (d, J=8.5 Hz, 2 H), 9.17 (s, 1 H), 9.38 (s, 1 H), 11.81 (s, 1 H). [M+H] calc'd for C15H10ClIN2O3S, 461, 463; found, 461, 463.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08420816B2 |
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| Source dataset | uspto-grants-2013_04 |
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| ORD ID | ord-dafeb79f47ff419fa684d5d6abd18c2b |
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| Source note | uspto-grants-2013_04 |
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