HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 860406Generated: October 25, 2026
Sodium hydride → 4-[(1-amino-5-ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile
https://huagongshe.com/reaction/860406
Participants
| Role | Name | HCID | Charge |
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| Reactant | Sodium hydride | HCID 24758 | — |
| Reactant | O-(2,4-dinitrophenyl)hydroxylamine | HCID 87140 | — |
| Reactant | 4-[(5-Ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile | HCID 45095529 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | 4-[(1-amino-5-ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile | HCID 57444479 | 60.7% |
Reaction Steps
To a solution of 4-[(5-ethyl-1H-pyrrol-2-yl)carbonyl]-benzonitrile (12.5 g) in N,N-dimethylformamide (63 mL) was added 60% sodium hydride in oil (2.68 g) in an ice-water bath under N2. After 30 minutes, to the mixture was added 1-(aminooxy)-2,4-dinitrobenzene (13.3 g). After 2 hours, the mixture was partitioned between ethyl acetate and water. The aqueous layer was extracted with ethyl acetate. The combined organic layer was washed with water (100 mL) 3 times, 1N sodium hydroxide (100 mL), and brine, dried over magnesium sulfate, and evaporated in vacuo. The residue was purified by flash silica gel chromatography (silica gel, 500 mL) eluted with hexane-chloroform=1-2, 1-5, and 1-10 followed by triturated with isopropyl ether to give 4-[(1-amino-5-ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile (8.1 g, 60.7%) as an yellow solid. The mixed fraction and the mother layer (7 g) were repurified by flash silica gel chromatography (silica gel, 200 mL) eluted with hexane-chloroform=2-1 and 1-1 followed by triturated with isopropyl ether to give 4-[(1-amino-5-ethyl-1H-pyrrol-2-yl)carbonyl]benzonitrile (2.0 g, 15%) as a pale yellow solid.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07153854B2 |
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| Source dataset | uspto-grants-2006_12 |
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| ORD ID | ord-51ce0a4a3ef046a8bd6d63c4cad8475e |
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| Source note | uspto-grants-2006_12 |
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