HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 77734Generated: October 30, 2026
3-Nitrophenylboronic Acid → HCID 69043081, compound
https://huagongshe.com/reaction/77734
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | 3-Nitrophenylboronic Acid | HCID 1677 | — |
| Reactant | Potassium Carbonate | HCID 11430 | — |
| Reactant | N-(5-iodo-6-methylpyridin-3-yl)-3-(trifluoromethyl)benzamide | HCID 69042846 | — |
| Catalyst | HCID 178418397 | HCID 178418397 | — |
| Solvent | Ethanol | HCID 702 | — |
| Solvent | Water | HCID 962 | — |
| Solvent | Toluene | HCID 1140 | — |
| Product | HCID 69043081 | HCID 69043081 | 75% |
Reaction Steps
(3-Nitrophenyl)boronic acid (0.086 g, 0.52 mmol) was mixed with N-(5-iodo-6-methylpyridin-3-yl)-3-(trifluoromethyl)benzamide (0.21 g, 0.52 mmol) and potassium carbonate (0.13 g, 0.91 mmol) in toluene (3.8 mL), ethanol (0.56 mL) and water (0.5 mL) and the solution was degassed. Into the reaction was added tetrakis(triphenylphosphine)palladium(0) (0.025 g, 0.022 mmol) and was refluxed for 18 hours. The reaction was extracted with EtOAc and the organic extracts were washed with water, saturated NaCl, dried (MgSO4) and stripped in vacuo. The residue was purified by column chromatography using 40% EtOAc/hexanes to give the product (0.156 g, 75% yield). 1H NMR (400 MHZ, CDCl3): δ 8.67 (d, 1H), 8.28 (m, 2H), 8.16 (brs, 1H), 8.11 (m, 1H), 7.99 (brs, 1H), 7.85 (m, 1H), 7.69 (m, 4H), 2.52 (s, 3H); MS (ES) (M+H)=402.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US08841318B2 |
|---|
| Source dataset | uspto-grants-2014_09 |
|---|
| ORD ID | ord-074e9485306d415dbcea9e5160126457 |
|---|
| Source note | uspto-grants-2014_09 |
|---|