HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1193049Generated: October 29, 2026
Triethylamine → Tert-butyl 3,8-diazabicyclo[4.2.0]octane-3-carboxylate
https://huagongshe.com/reaction/1193049
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | Di-tert-butyl dicarbonate | HCID 90495 | — |
| Reactant | Ethyl 3-oxo-1-(phenylmethyl)-4-piperidinecarboxylate | HCID 419705 | — |
| Reactant | 1-tert-Butyl 4-ethyl 3-oxopiperidine-1,4-dicarboxylate | HCID 15852989 | — |
| Catalyst | Palladium hydroxide | HCID 9942167 | — |
| Solvent | Ethanol | HCID 702 | — |
| Product | Tert-butyl 3,8-diazabicyclo[4.2.0]octane-3-carboxylate | HCID 43810891 | 94.25% |
Reaction Steps
3-Oxo-piperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester. A mixture of 1-benzyl-3-oxo-piperidine-4-carboxylic acid ethyl ester (11.31 g, 38 mmol), di-t-butyl dicarbonate (8.78 g, 40.2 mmol), Et3N (5.4 mL, 38.7 mmol) and Pd(OH)2 on carbon (20% on dry basis-Pearlman's catalyst) (1.3 g) were taken into EtOH (110 mL). The mixture was hydrogenated at 60 psi for 24 h in a Parr bottle. The catalyst was removed by filtration and the filtrate was concentrated to dryness to tan solid. Crude residue was shaken well with hexane (100 mL) and filtered. The filtrate was concentrated to yield the title compound (9.70 g, 94.25%). MS (ESI) mass calcd. for C13H21NO5, 271.32; 1H NMR (400 MHz, CDCl3) 4.24 (q, J=7.1, 2H), 4.03 (s br, 2H), 3.49 (t, J=5.6, 2H), 2.32 (m, 3H), 1.47 (s, 9H), 1.31 (t, J=7.1, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08680275B2 |
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| Source dataset | uspto-grants-2014_03 |
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| ORD ID | ord-25cf3afc30354182b238dc48eadbbf23 |
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| Source note | uspto-grants-2014_03 |
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