HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 453552Generated: October 29, 2026
Hydrochloric Acid → Tert-butyl 2-(3-cyano-4-fluorophenyl)propanoate
https://huagongshe.com/reaction/453552
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Methyl iodide | HCID 6328 | — |
| Reactant | Diisopropylamine | HCID 7912 | — |
| Reactant | Tert-butyl 2-(3-cyano-4-fluorophenyl)acetate | HCID 45925946 | — |
| Reactant | Butyllithium | HCID 178418339 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | Tert-butyl 2-(3-cyano-4-fluorophenyl)propanoate | HCID 68467119 | — |
Reaction Steps
To a stirred solution of diisopropylamine in 2 ml of THF at −78° C. was added n-butyl lithium (0.61 ml). The reaction was stirred for 30 minutes after which time a solution of tert-butyl 2-(3-cyano-4-fluorophenyl)acetate (0.300 g) in THF (2 ml) was added dropwise over 20 minutes at −78° C. The reaction was warmed to 0° C. and then transferred a flask containing 2 ml THF and MeI (0.080 ml). The reaction was acidified with 2M HCl and extracted with ethyl acetate. The combined organics were then washed with brine and dried over MgSO4. The concentrated product was purified by silica gel chromatography using a solvent system of 5% to 50% ethyl acetate/hexanes to provide tert-butyl 2-(3-cyano-4-fluorophenyl)propanoate (0.140 g).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08492437B2 |
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| Source dataset | uspto-grants-2013_07 |
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| ORD ID | ord-0ab84e105de94641957e4c8c79a6f7e0 |
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| Source note | uspto-grants-2013_07 |
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