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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 479823Generated: October 26, 2026

Aluminium lithium hydride → (1-Benzylazepan-3-yl)methanol

https://huagongshe.com/reaction/479823

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAluminium lithium hydrideHCID 21226445—
ReactantMethyl 1-benzyl-2-oxoazepane-3-carboxylateHCID 21902024—
SolventTetrahydrofuranHCID 8028—
ProductAmmoniaHCID 222—
Product(1-Benzylazepan-3-yl)methanolHCID 21901990117.5%

Reaction Steps

1-Benzyl-2-oxo-azepan-2-carboxylic acid methyl ester (143) (0.2154 g, 0.8243 mmol) dissolved in anhydrous THF (2.9 mL) was added to a stirring suspension of LiAlH4 in THF (1.5 mL) over approx. 1.5 hours. The reaction mixture was stirred overnight. The reaction was judged complete by TLC and was quenched by the sequential addition of H2O (0.4 mL), then 2N NaOH (1.0 mL) and H2O (0.4 mL). The mixture was stirred at room temperature for 30 minutes, then was filtered, dried with Na2SO4, and concentrated in vacuo. Crude material was purified by automated silica gel chromatography with 15:85:5 CH2Cl2:Hexanes:2N NH3 in EtOH to obtain 0.1062 g (59%) of pure (1-benzyl-azepan-3-yl)-methanol (144). 1H NMR (CDCl3) 7.40-7.23 (5H, m), 3.65 (2H, s), 3.54 (1H, dd, J=10.4, 3.5 Hz), 3.43 (1H, dd, J=10.4, 5.4 Hz), 2.82 (1H, J=13.3, 3.1 Hz), 2.77 (2H, m), 2.44 (1H, ddd, J=12.2, 8.6, 3.3 Hz), 1.90-1.45 (6H, m) ppm. 13C NMR (CDCl3, 75 MHz) 139.14, 128.97, 128.14, 126.91, 67.20, 63.85, 58.49, 56.87, 39.59, 29.68, 29.43, 25.23 ppm. LRMS: 219.64.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS06645980B1
Source datasetuspto-grants-2003_11
ORD IDord-3581611d190b4dc098ab21c7d17e8b0b
Source noteuspto-grants-2003_11