Experimental and Theoretical Investigations of the Bromination of Phenols with 尾 and 纬 Aliphatic Substituents, including Rings

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• 作者：Jinsong Zhang ; Xiao Chang ; Erich C. Bowman ; Carter J. Holt ; Michael W. Lodewyk ; Randy M. Miller ; Guangming Xia
• 刊名：Journal of Organic Chemistry
• 出版年：2015
• 出版时间：September 18, 2015
• 年：2015
• 卷：80
• 期：18
• 页码：9292-9296
• 全文大小：288K
• ISSN：1520-6904

文摘

Bromination reactions of substituted and ring fused phenols were studied by both experiment (t-BuNH-Br) and computation (density functional theory). The outcomes support each other, indicating a clear and predictable regioselective preference among 3,4-bis-alkylated and 3,4-ring-fused phenols.