HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 475680Generated: October 29, 2026
Isopropanol → 2'-Fluoro-4'-methylbiphenyl-2-carboxylic acid t-butyl ester
https://huagongshe.com/reaction/475680
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isopropanol | HCID 3776 | — |
| Reactant | Sodium Carbonate | HCID 10340 | — |
| Reactant | (2-Fluoro-4-methylphenyl)boronic acid | HCID 2783132 | — |
| Reactant | tert-Butyl 2-bromobenzoate | HCID 3804415 | — |
| Catalyst | HCID 178418397 | HCID 178418397 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Ethyl Acetate | HCID 8857 | — |
| Product | 2'-Fluoro-4'-methylbiphenyl-2-carboxylic acid t-butyl ester | HCID 59283899 | 96% |
Reaction Steps
Compound A (22.8 g, 88.6 mmol) and 2-fluoro-4-methylphenylboronic acid (15.0 g, 97.4 mmol) were suspended in isopropyl alcohol (75 mL, 980 mmol). A solution of sodium carbonate (16 g, 150 mmol) in water (75 mL, 4.2 mol) was added and the mixture was degassed under nitrogen. Tetrakis(triphenylphosphine)palladium(0) (1.0 g, 880 μmol) was then added and the mixture was stirred at 90° C. overnight. The mixture was cooled to room temperature, EtOAc (200 mL) and water (200 mL) were added, and the mixture was filtered. The liquor was extracted with EtOAc (2×100 mL), washed with saturated aqueous NaCl, dried over MgSO4, filtered and concentrated. The material was purified by flash chromatography (0-15% EtOAc in hexanes) to yield compound B as a colorless oil (14.9 g, 96% purity).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08637562B2 |
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| Source dataset | uspto-grants-2014_01 |
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| ORD ID | ord-dc98c62460674246b441502704cf7e7d |
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| Source note | uspto-grants-2014_01 |
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