HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1867783Generated: November 1, 2026
Triphenylphosphine → Methyl 4'-(trifluoromethyl)[1,1'-biphenyl]-4-carboxylate
https://huagongshe.com/reaction/1867783
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Triphenylphosphine | HCID 11776 | — |
| Reactant | Methyl 4-bromobenzoate | HCID 12081 | — |
| Reactant | Cesium fluoride | HCID 25953 | — |
| Reactant | 4-(Trifluoromethyl)phenylboronic acid | HCID 2734389 | — |
| Catalyst | palladium(II) acetate | HCID 167845 | — |
| Solvent | Acetone | HCID 180 | — |
| Solvent | Methanol | HCID 887 | — |
| Solvent | 1,2-Dimethoxyethane | HCID 8071 | — |
| Product | Methyl 4'-(trifluoromethyl)[1,1'-biphenyl]-4-carboxylate | HCID 4328569 | 92% |
Reaction Steps
Procedure A′: A suspension of 4-(trifluoromethyl)phenylboronic acid (7.3 g, 38.4 mmol), methyl 4-bromobenzoate (7.44 g, 36.4 mmol), triphenylphosphine (1.21 g, 4.6 mmol), cesium fluoride (11.7 g, 76.8 mmol) and palladium acetate (0.26 g, 1.15 mmol) in degassed DME and methanol is heated at reflux for 24 h. The suspension is cooled to room temperature, filtered, and the resulting filtrate concentrated in vacuo to give a dark solid. This material is taken up in acetone and adsorbed on silica gel, and purified by flash filtration using 500 mL each of 2% to 20% ethyl acetate/hexanes in 2% increments. Fractions containing the product are combined to give the title compound in 92% yield. NMR (CDCl3) 8.10 (d, J=8.4 Hz, 2H), 7.99 (d, J=7.9 Hz, 2H), 7.92 (d, J=8.4 Hz, 2H), 7.83 (d, 8.4 Hz, 2H), 3.58 (s, 3H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US07632857B2 |
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| Source dataset | uspto-grants-2009_12 |
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| ORD ID | ord-d38624da69eb4d1b82f5750807af28d8 |
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| Source note | uspto-grants-2009_12 |
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