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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1396534Generated: November 1, 2026

Pinacol → 2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile

https://huagongshe.com/reaction/1396534

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPinacolHCID 6425—
Reactant(4-Cyano-3-fluorophenyl)boronic acidHCID 2783130—
SolventCyclohexaneHCID 8078—
Product2-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrileHCID 5135095185.6%

Reaction Conditions

Temperature40 °C

Reaction Steps

A suspension of the crude 3-fluoro-4-cyanophenyl boronic acid (9.2 Kg, 55.8 mol) in cyclohexane (150 L) was treated with pinacol (13.2 Kg, 111.6 mol, 2.0 equiv) at room temperature, and the resulting reaction mixture was warmed to 40° C. for 4 h. When TLC and LC/MS showed that the reaction was deemed complete, the reaction mixture was cooled down to room temperature before being washed with water (2×75 L). The organic layer was then dried over magnesium sulfate (MgSO4) and concentrated under the reduced pressure to afford 2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzonitrile (19, 11.8 Kg, 13.8 Kg theoretical, 85.6% yield) as a light yellow solid. For 19: 1H NMR (300 MHz, DMSO-d6) δ ppm 7.92 (t, 1H, J=7.00 Hz), 7.62 (m, 2H), 1.29 (s, 12H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08901123B2
Source datasetuspto-grants-2014_12
ORD IDord-5006a6a9c26b4d71ae57c5ea0b9f1068
Source noteuspto-grants-2014_12