HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2173797Generated: October 30, 2026
4-(Trifluoromethyl)phenylboronic acid → 2,6-Dimethyl-4-nitro-4'-(trifluoromethyl)biphenyl
https://huagongshe.com/reaction/2173797
Participants
| Role | Name | HCID | Charge |
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| Reactant | 4-(Trifluoromethyl)phenylboronic acid | HCID 2734389 | — |
| Reactant | 2-Bromo-1,3-dimethyl-5-nitrobenzene | HCID 7022096 | — |
| Reactant | Potassium fluoride hydrate | HCID 23675105 | — |
| Catalyst | HCID 178418397 | HCID 178418397 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | 2,6-Dimethyl-4-nitro-4'-(trifluoromethyl)biphenyl | HCID 67485659 | 43.4% |
Reaction Steps
To a solution of 2-bromo-1,3-dimethyl-5-nitrobenzene (2.7 g, 11.7 mmol) in toluene (36 mL) was added tetrakis(triphenylphosphine)palladium(0) (1.36 g, 1.17 mmol), 4-(trifluoromethyl)phenylboronic acid (4.46 g, 23.5 mmol), and potassium fluoride hydrate (3.31 g, 43 mmol). The reaction was purged with nitrogen three times. Water (9 mL) was added and the reaction was refluxed overnight. The reaction was diluted with saturated ammonium chloride and the layers were separated. The organic layer was washed with water (3×40 mL) and brine, dried over sodium sulfate, filtered and concentrated. Purification by column chromatography gave 2,6-dimethyl-4-nitro-4′-(trifluoromethyl)biphenyl (1.5 g, 43%) as a yellow solid. 1H NMR (400 MHz, CDCl3, δ): 7.99 (s, 2H), 7.75 (d, 2H), 7.26 (s, 1H), 7.25 (s, 1H), 2.10 (s, 6H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US09056834B2 |
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| Source dataset | uspto-grants-2015_06 |
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| ORD ID | ord-58cee13e4f6843d287259b3071ce736e |
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| Source note | uspto-grants-2015_06 |
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