Methyl 2-acetyl-6-hydroxyundec-4-ynoate | 265093-88-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: Methyl 2-acetyl-6-hydroxyundec-4-ynoate
• CAS: 265093-88-7
• 化学式: C₁₄H₂₂O₄
• 分子量: 254.326
• InChiKey: WTPHGWFAHSXTEC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  18
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  63.6
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  Methyl 2-acetyl-6-hydroxyundec-4-ynoate 在 戴斯-马丁氧化剂 、 三乙胺 作用下， 以 正己烷 为溶剂， 反应 0.08h， 生成 2-methyl-3-carbomethoxy-5-(2-ketoheptyl)furan
  参考文献：
  名称：

  A new synthesis of 3-carboxy-2,5-disubstituted furans and their conversion to 5-vinyl derivatives

  摘要：

  A new route to the title compounds is described. The key transformation involves treatment of a 2-(4-keto-2-alkynyl)-3-ketobutanoate with silica gel or Et3N to effect ring closure and subsequent double bond isomerization. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)02290-x
• 作为产物：
  描述：

  4-[Tert-butyl(dimethyl)silyl]oxynon-2-yn-1-ol 在 三氟化硼乙醚 、 sodium hexamethyldisilazane 、 四丁基碘化铵 、 三乙胺 作用下， 生成 Methyl 2-acetyl-6-hydroxyundec-4-ynoate
  参考文献：
  名称：

  A new synthesis of 3-carboxy-2,5-disubstituted furans and their conversion to 5-vinyl derivatives

  摘要：

  A new route to the title compounds is described. The key transformation involves treatment of a 2-(4-keto-2-alkynyl)-3-ketobutanoate with silica gel or Et3N to effect ring closure and subsequent double bond isomerization. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)02290-x

文献信息

• A new synthesis of 3-carboxy-2,5-disubstituted furans and their conversion to 5-vinyl derivatives
  作者：James A. Marshall、Dong Zou

  DOI：10.1016/s0040-4039(99)02290-x

  日期：2000.2

  A new route to the title compounds is described. The key transformation involves treatment of a 2-(4-keto-2-alkynyl)-3-ketobutanoate with silica gel or Et3N to effect ring closure and subsequent double bond isomerization. (C) 2000 Elsevier Science Ltd. All rights reserved.