(4-Tert-butylcyclohexyl) 2,2-dimethylpent-4-enoate | 214853-58-4

• 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: (4-Tert-butylcyclohexyl) 2,2-dimethylpent-4-enoate
• CAS: 214853-58-4
• 化学式: C₁₇H₃₀O₂
• 分子量: 266.424
• InChiKey: BSBBZSSMXHNJAD-UHFFFAOYSA-N

物化性质

• 沸点：
  309.6±11.0 °C(Predicted)
• 密度：
  0.91±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  19
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (4-Tert-butylcyclohexyl) 2,2-dimethylpent-4-enoate 在 sodium hydroxide 、 9-borabicyclononane 、 双氧水 作用下， 生成 4-叔丁基环己醇
  参考文献：
  名称：

  Pinacol-type rearrangements of intramolecular photocycloadducts: Application of the 2,2-dimethyl-4-pentenoate protecting group

  摘要：

  A pinacol-type rearrangement of intramolecular photocycloadducts has been accomplished by exploiting a novel ester protecting group that can be easily removed from a hindered alcohol. The ester is removed by an intramolecular lactonization, overcoming the steric factors normally associated with pivalate esters. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)01465-8
• 作为产物：
  描述：

  2,2-二甲基-4-戊烯酸 在 氯化亚砜 、 三乙胺 作用下， 以 二氯甲烷 、 苯 为溶剂， 反应 30.0h， 生成 (4-Tert-butylcyclohexyl) 2,2-dimethylpent-4-enoate
  参考文献：
  名称：

  Pinacol-type rearrangements of intramolecular photocycloadducts: Application of the 2,2-dimethyl-4-pentenoate protecting group

  摘要：

  A pinacol-type rearrangement of intramolecular photocycloadducts has been accomplished by exploiting a novel ester protecting group that can be easily removed from a hindered alcohol. The ester is removed by an intramolecular lactonization, overcoming the steric factors normally associated with pivalate esters. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)01465-8

文献信息

• Pinacol-type rearrangements of intramolecular photocycloadducts: Application of the 2,2-dimethyl-4-pentenoate protecting group
  作者：Michael T. Crimmins、Charlotte A. Carroll、Angela J. Wells

  DOI：10.1016/s0040-4039(98)01465-8

  日期：1998.9

  A pinacol-type rearrangement of intramolecular photocycloadducts has been accomplished by exploiting a novel ester protecting group that can be easily removed from a hindered alcohol. The ester is removed by an intramolecular lactonization, overcoming the steric factors normally associated with pivalate esters. (C) 1998 Elsevier Science Ltd. All rights reserved.