1,3-Bis(2-heptynoyl)benzene | 192993-52-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,3-Bis(2-heptynoyl)benzene
• 英文别名: 2-Heptyn-1-one, 1,1'-(1,3-phenylene)bis-；1-(3-hept-2-ynoylphenyl)hept-2-yn-1-one
• CAS: 192993-52-5
• 化学式: C₂₀H₂₂O₂
• 分子量: 294.393
• InChiKey: VGFFVDMJBSKVFY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  22
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  苯甲醇 、 1,3-Bis(2-heptynoyl)benzene 在 三丁基膦 作用下， 以87%的产率得到(Z)-3-Benzyloxy-1-[3-((Z)-3-benzyloxy-hept-2-enoyl)-phenyl]-hept-2-en-1-one
  参考文献：
  名称：

  Novel Phosphine-Catalyzed Zipper Cyclization of Aliphatic Diyne−Dione and Yne−Dione Systems

  摘要：

  An unexpected tri-n-butylphosphine-catalyzed zipper cyclization of diyne-diones (1a-d) or yne-diones (1e and 1f) is described. Bicyclic ketones (2a, 2b, 2c, 2e, and 2f) with five- or six-membered rings fused to the five-membered ring were obtained from both aliphatic diyne-diones (1a-c) and yne-diones (le and 10 having tetra- or pentamethylene spacers. The bicyclic products (2) were produced with high diastereoselectivity.

  DOI：

  10.1021/ol020198n

文献信息

• Novel Phosphine-Catalyzed Zipper Cyclization of Aliphatic Diyne−Dione and Yne−Dione Systems
  作者：Hirofumi Kuroda、Ikuyoshi Tomita、Takeshi Endo

  DOI：10.1021/ol020198n

  日期：2003.1.1

  An unexpected tri-n-butylphosphine-catalyzed zipper cyclization of diyne-diones (1a-d) or yne-diones (1e and 1f) is described. Bicyclic ketones (2a, 2b, 2c, 2e, and 2f) with five- or six-membered rings fused to the five-membered ring were obtained from both aliphatic diyne-diones (1a-c) and yne-diones (le and 10 having tetra- or pentamethylene spacers. The bicyclic products (2) were produced with high diastereoselectivity.