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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1348900Generated: November 1, 2026

Sodium borohydride → 2-Fluoro-4-(hydroxymethyl)benzonitrile

https://huagongshe.com/reaction/1348900

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium borohydrideHCID 4311764—
ReactantCalcium ChlorideHCID 5284359—
ReactantMethyl 4-cyano-3-fluorobenzoateHCID 17965941—
SolventEthanolHCID 702—
SolventTetrahydrofuranHCID 8028—
Product2-Fluoro-4-(hydroxymethyl)benzonitrileHCID 11829631—

Reaction Steps

A solution of Example 52A (1.0 g, 5.58 mmol) in THF (20 mL) at room temperature was treated with a solution of CaCl2 (1.24 g, 11.16 mmol) in ethanol (20 mL). The resulting solution was treated with NaBH4 (845 mg, 22.33 mmol) over 20 minutes, stirred for 1.25 hours, then slowly quenched with saturated ammonium chloride (100 mL), and concentrated. The remaining aqueous portion was extracted with ethyl acetate (3×100 mL) and the combined extracts were dried (MgSO4), filtered, and concentrated to provide the desired product. MS (APCI) m/z 169 (M+NH4)+; 1H NMR (300 MHz, CDCl3) δ 7.60 (t, 1H), 7.29-7.23 (m, 2H), 4.80 (s, 2H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07211595B2
Source datasetuspto-grants-2007_05
ORD IDord-fd8118ff7b6345f88d65e12b503fc932
Source noteuspto-grants-2007_05