6-bromohexyl 4-chlorophenyl ether -Drug Synthesis Database

【结构式】

【分子编号】24870

【品名】6-bromohexyl 4-chlorophenyl ether

【CA登记号】

【分子式】C₁₂H₁₆BrClO

【分子量】291.61514

【元素组成】C 49.43% H 5.53% Br 27.4% Cl 12.16% O 5.49%

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：(VII)

2) Alternatively, etomoxir can be prepared as follows: Alkylation of 4-chlorophenol with 1,6-dibromohexane (I) yields 1 bromo-6-(4-chlorophenoxy)hexane (VII). Diethyl malonate (II) is alkylated by (VII), yielding (VIII), followed by hydrolysis to the monoester (IX), which is condensed with para formaldehyde/pyridine/piperidine to give ethyl 8-(4-chlorophenoxy)-2-methyleneoctanoate (IX). Oxidation with m-chloroperbenzoic acid produces etomoxir.

参考文献中间体

合成目标

【1】 Eistetter, K.; Ludwig, G.; Rapp, E.; Wolf, H. (Byk Gulden Lomberg Chemische Fabrik GmbH); Phenoxyalkoxyalkyl- and phenoxyalkyl-substd. oxiranecarboxylic acids, their use and medicaments containing them. EP 0046590; US 4337267 .
【2】 Eistetter, K.; Wolf, H.P.O.; ETOMOXIR. Drugs Fut 1986, 11, 12, 1034.

中间体序号	中间体编号	品名	CAS号	分子式	供应商	用于合成
	35543	4-chlorophenol	106-48-9	C₆H₅ClO	详情	详情
(I)	24786	1,6-dibromohexane	629-03-8	C₆H₁₂Br₂	详情	详情
(II)	16829	Diethyl malonate	105-53-3	C₇H₁₂O₄	详情	详情
(VII)	24870	6-bromohexyl 4-chlorophenyl ether		C₁₂H₁₆BrClO	详情	详情
(VIII)	24871	diethyl 2-[6-(4-chlorophenoxy)hexyl]malonate		C₁₉H₂₇ClO₅	详情	详情
(IX)	24872	8-(4-chlorophenoxy)-2-(ethoxycarbonyl)octanoic acid		C₁₇H₂₃ClO₅	详情	详情
(X)	24873	ethyl 2-[6-(4-chlorophenoxy)hexyl]acrylate		C₁₇H₂₃ClO₃	详情	详情

Extended Information