2-(2-cyclohexyl-ethyl)-pent-4-enoic acid | 207451-67-0

• 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: 2-(2-cyclohexyl-ethyl)-pent-4-enoic acid
• 英文别名: 2-(2-Cyclohexyl-aethyl)-pent-4-ensaeure；α-Allyl-γ-cyclohexyl-buttersaeure；Allyl-(hexahydro-β-phenaethyl)-essigsaeure；Allyl-(β-cyclohexyl-aethyl)-essigsaeure；1-Cyclohexyl-hexen-(5)-carbonsaeure-(3)
• CAS: 207451-67-0
• 化学式: C₁₃H₂₂O₂
• 分子量: 210.316
• InChiKey: ISOPEOJNYOEXQW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.62
• 重原子数：
  15.0
• 可旋转键数：
  6.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  37.3
• 氢给体数：
  1.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  2-(2-cyclohexyl-ethyl)-pent-4-enoic acid 、 苯甲醇 、 alkaline earth salt of/the/ methylsulfuric acid 以34%的产率得到1-Benzyl-3-(2-cyclohexyl-ethyl)-1,3,4,7-tetrahydro-azepin-2-one
  参考文献：
  名称：

  Ring closing metathesis in organic synthesis: Evolution of a high speed, solid phase method for the preparation of β-turn mimetics

  摘要：

  Complimentary solid phase syntheses of the Freidinger lactam class of p-turn mimetics have been developed using ring closing metathesis as both the key carbon-carbon bond forming step and the cyclative cleavage mechanism. Solid phase variants of the Fukuyama-Mitsunobu process were utilized as pad of a rapid three-step sequence to construct immobilized lactam precursors, an alternative solid phase process is offered which utilizes an Ugi/ring closing metathesis reaction tandem to deliver the desired compounds in two synthetic operations. (C) 1999 Published by Elsevier Science Ltd, All rights reserved.

  DOI：

  10.1016/s0040-4020(99)00300-2
• 作为产物：
  描述：

  allyl-(2-cyclohexyl-ethyl)-malonic acid diethyl ester 在 氢氧化钾 作用下， 生成 2-(2-cyclohexyl-ethyl)-pent-4-enoic acid
  参考文献：
  名称：

  Adams et al., Journal of the American Chemical Society, 1927, vol. 49, p. 2937

  摘要：

  DOI：