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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2261994Generated: November 2, 2026

Water → 5-Ethynyl-2-methylaniline

https://huagongshe.com/reaction/2261994

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantPotassium HydroxideHCID 14797—
ReactantHCID 67044587HCID 67044587—
SolventTolueneHCID 1140—
SolventDiethyl EtherHCID 3283—
Product5-Ethynyl-2-methylanilineHCID 18925060—

Reaction Steps

A solution of 4-(3-amino-4-methylphenyl)-2-methylbut-3-yn-2-ol (509 mg, 2.7 mmol) in toluene (2 mL) was treated with potassium hydroxide (1.0 g, 18 mmol) at reflux for 20 min. After cooling to rt, water and ether were added, and the layers were partitioned. The organic phase was acidified with 4 N hydrochloric acid in dioxane (700 μL). The volatile materials were removed in vacuo providing a yellow/brown solid. The solid was taken up in ether and washed with saturated sodium bicarbonate. The organic phase was dried over magnesium sulfate, filtered, and concentrated carefully to avoid loss of the moderately volatile product. Desired 5-ethynyl-2-methylaniline was isolated as an oil in quantitative yield, contaminated with 10% ether by mass. 1H NMR (400 MHz, CDCl3): 6.99 (d, 1H), 6.85 (dd, 1H), 6.81 (d, 1H), 3.61 (br s, 2H), 2.98 (s, 1H), 2.16 (s, 3H); GCMS for C9H9N: 131 (M+).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07846959B2
Source datasetuspto-grants-2010_12
ORD IDord-86500d69cac54b7cad0d1441f8c05246
Source noteuspto-grants-2010_12