HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1514240Generated: November 4, 2026
Ethyl 4-bromobutyrate → HCID 59403493, compound
https://huagongshe.com/reaction/1514240
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethyl 4-bromobutyrate | HCID 76300 | — |
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | HCID 44129142 | HCID 44129142 | — |
| Solvent | Acetonitrile | HCID 6342 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | HCID 59403493 | HCID 59403493 | 58.8% |
Reaction Steps
7-(5-{3-Chloro-4-[(1-methylethyl)oxy]phenyl}-1,2,4-oxadiazol-3-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine (0.105 g, 0.272 mmol) was stirred in acetonitrile (2 ml). DIPEA (0.095 ml, 0.544 mmol) and ethyl 4-bromobutanoate (0.058 ml, 0.408 mmol) were added and the reaction mixture heated at 80° C. under Argon for 5 hours. Additional DIPEA (0.095 ml, 0.544 mmol) and ethyl 4-bromobutanoate (0.058 ml, 0.408 mmol) were added and the reaction mixture heated at 80° C. overnight. Then the reaction mixture was dissolved in EtOAc (20 ml), washed with NaHCO3 (aq) (15 ml×3) and with water (15 ml×3) and the organics dried (MgSO4) and evaporated. The crude was purified by flash chromatography eluting with EtOAc/iso-Hexane 20/30% (Biotage column), and evaporated to give the title compounds as an oil (80 mg). MS (ES): C26H3035ClN3O5 requires 499; found 500 [M+H]+.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08222245B2 |
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| Source dataset | uspto-grants-2012_07 |
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| ORD ID | ord-d3f62dbfc12f4123b036eb095367be04 |
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| Source note | uspto-grants-2012_07 |
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