2-叔丁基-4-(甲氧基甲基)呋喃 | 790713-54-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 中文名称: 2-叔丁基-4-(甲氧基甲基)呋喃
• 英文名称: 2-tert-butyl-4-(methoxymethyl)furan
• 英文别名: 2-t-Butyl-4-(methoxymethyl)furan
• CAS: 790713-54-1
• 化学式: C₁₀H₁₆O₂
• 分子量: 168.236
• InChiKey: KUWKMDSATRGQPX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  22.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-叔丁基-4-(甲氧基甲基)呋喃 在 溴 、 三苯基膦 作用下， 以 乙腈 、 苯 为溶剂， 反应 14.0h， 生成 3-(diethoxyphosphorylmethyl)-5-tert-butylfuran
  参考文献：
  名称：

  Synthesis and Phosphorylation of 2-, 3-, and 4-Halomethyl-5-tert-butylfurans

  摘要：

  Synthetic methods for preparing of 2-, 3-, and 4-halomethyl-5-tert-butylfurans are developed. It was established that the bromination of 3- and 4-methyl-2-tert-butylfurans with N-bromosuccinimide proceeds mainly at the free alpha-position of the furan ring, and not at the methyl group. Therefore, the target halomethylfurans were prepared through the corresponding 3- and 4-methoxymethyl derivatives. The obtained five products were phosphorylated with sodium diethyl phosphite under the conditions of the Michaelis-Becker reaction to give the corresponding phosphonates.

  DOI：

  10.1023/b:rugc.0000031868.97123.e1
• 作为产物：
  描述：

  methyl 3-bromomethyl-5-tert-butylfuran-2-carboxylate 在 氢氧化钾 、 sodium methylate 、 copper(II) oxide 作用下， 以 喹啉 、 水 为溶剂， 反应 3.0h， 生成 2-叔丁基-4-(甲氧基甲基)呋喃
  参考文献：
  名称：

  Synthesis and Phosphorylation of 2-, 3-, and 4-Halomethyl-5-tert-butylfurans

  摘要：

  Synthetic methods for preparing of 2-, 3-, and 4-halomethyl-5-tert-butylfurans are developed. It was established that the bromination of 3- and 4-methyl-2-tert-butylfurans with N-bromosuccinimide proceeds mainly at the free alpha-position of the furan ring, and not at the methyl group. Therefore, the target halomethylfurans were prepared through the corresponding 3- and 4-methoxymethyl derivatives. The obtained five products were phosphorylated with sodium diethyl phosphite under the conditions of the Michaelis-Becker reaction to give the corresponding phosphonates.

  DOI：

  10.1023/b:rugc.0000031868.97123.e1