HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 446141Generated: October 25, 2026
1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide → 5-(tert-Butyl)-3,3-dimethyl-6-nitrobenzofuran-2(3H)-one
https://huagongshe.com/reaction/446141
Participants
| Role | Name | HCID | Charge |
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| Reactant | 1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide | HCID 15908 | — |
| Reactant | 2-(5-Tert-butyl-2-hydroxy-4-nitrophenyl)-2-methylpropanoic acid | HCID 59544150 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | 5-(tert-Butyl)-3,3-dimethyl-6-nitrobenzofuran-2(3H)-one | HCID 59544154 | — |
Reaction Steps
To a solution of compound 18 (7.10 g, 25.2 mmol) in 710 mL of anhydrous THF was added EDCI (14.5 g, 75.6 mmol). The resulting suspension was left stirring at 30° C. overnight. The precipitate was filtered and thoroughly washed with DCM. The filtrate was concentrated to dryness and the residue was dissolved in DCM (100 mL). The solution was washed with water (50 mL×2) and brine (50 mL×1). The DCM layer was then dried over anhydrous Na2SO4 and concentrated to give the crude product, which was purified via column chromatography on silica gel (Petroleum ether/EtOAc 200:1→100:1→50:1) to give compound 19 as a white solid. 1H NMR (CDCl3; 400 MHz) δ 7.36 (s), δ 7.10 (s), δ 1.53 (s), δ 1.41 (s).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08476442B2 |
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| Source dataset | uspto-grants-2013_07 |
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| ORD ID | ord-f1cbfc004dc74e56b8a9ebbb0701dcac |
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| Source note | uspto-grants-2013_07 |
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