4-(2-chloroethoxy)benzoic acid -Drug Synthesis Database

【结构式】

【分子编号】39010

【品名】4-(2-chloroethoxy)benzoic acid

【CA登记号】

【分子式】C₉H₉ClO₃

【分子量】200.62136

【元素组成】C 53.88% H 4.52% Cl 17.67% O 23.92%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号：(IV)

This compound can be obtained in several different ways: 1) The condensation of imidazole (I) with 4-(2-chloroethoxy)benzamide (II) by means of NaH in DMF gives 1-[2-(4-carbamoylphenoxy)ethyl]imidazole (III), which is hydrolyzed by refluxing with 5N aqueous HCl. 2) Esters of 4-(2-chloroethoxy)benzoic acid (IV) can also be used instead of (II) in the first step of the synthesis. 3) This compound can also be obtained by direct condensation of imidazole (I) with 4-(2-chloroethoxy)benzoic acid (IV) by means of NaH in THF.

参考文献中间体

合成目标

【1】 DE 2950019 .
【2】 Sneddon, J.; Castaner, J.; UK-37,248-01. Drugs Fut 1981, 6, 11, 693.

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
(I)	10255	Imidazole; 1H-Imidazole	288-32-4	C₃H₄N₂	详情	详情
(II)	39008	4-(2-chloroethoxy)benzamide		C₉H₁₀ClNO₂	详情	详情
(III)	39009	4-[2-(1H-imidazol-1-yl)ethoxy]benzamide		C₁₂H₁₃N₃O₂	详情	详情
(IV)	39010	4-(2-chloroethoxy)benzoic acid		C₉H₉ClO₃	详情	详情

Extended Information