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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1427900Generated: November 2, 2026

Potassium Phosphate, Tribasic → Methyl 6-(adamantan-1-ylmethoxy)-5-cyclopropylnicotinate

https://huagongshe.com/reaction/1427900

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPotassium Phosphate, TribasicHCID 62657—
ReactantCyclopropylboronic acidHCID 2760897—
ReactantTri(cyclohexyl)phosphine tetrafluoroborateHCID 20066521—
ReactantMethyl 6-(adamantan-1-ylmethoxy)-5-chloronicotinateHCID 86702922—
Catalystpalladium(II) acetateHCID 167845—
SolventTolueneHCID 1140—
ProductMethyl 6-(adamantan-1-ylmethoxy)-5-cyclopropylnicotinateHCID 8670292389.2%

Reaction Steps

A mixture of methyl 6-(adamantan-1-ylmethoxy)-5-chloronicotinate (1.29 g, 3.84 mmol), cyclopropylboronic acid (0.43 g, 4.99 mmol), potassium phosphate (3.26 g, 15.40 mmol), tricyclohexylphosphine tetrafluoroborate (0.14 g, 0.38 mmol) and palladium acetate (0.04 g, 0.19 mmol) in degassed toluene (50 mL) and degassed water (5 mL) was refluxed under nitrogen for 7 h. The reaction mixture was cooled to ambient temperature and diluted with ethyl acetate (100 mL), washed with water (50 mL), saturated ammonium chloride (50 mL) and brine (50 mL); dried over anhydrous sodium sulfate, filtered through diatomaceous earth and concentrated in vacuo. The residue was purified by flash chromatography eluting with 5% ethyl acetate in hexanes to afford the title compound as a white solid (1.17 g, 89%); 1H NMR (300 MHz, CDCl3) δ 8.57 (d, J=2.2 Hz, 1H), 7.67 (d, J=2.2 Hz, 1H), 3.95 (s, 2H), 3.85 (s, 3H), 2.09-1.96 (m, 4H), 1.78-1.63 (m, 12H), 0.99-0.91 (m, 2H), 0.72-0.65 (m, 2H); MS (ES+) m/z: 342.22 (M+1).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08933236B2
Source datasetuspto-grants-2015_01
ORD IDord-4d039d9b3bf44f8587cd653f1bfc61d1
Source noteuspto-grants-2015_01