3-(butylthio)-3-phenylpropan-1-ol | 1017904-13-0

• 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: 3-(butylthio)-3-phenylpropan-1-ol
• 英文别名: 3-Butylsulfanyl-3-phenylpropan-1-ol
• CAS: 1017904-13-0
• 化学式: C₁₃H₂₀OS
• 分子量: 224.367
• InChiKey: TUZSOLPESPOPLF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  15
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  45.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  3-(Butylthio)benzenepropanal 在 sodium tetrahydroborate 作用下， 以 乙醇 为溶剂， 以50%的产率得到3-(butylthio)-3-phenylpropan-1-ol
  参考文献：
  名称：

  Hydrochalcogenation of activated olefines. Synthesis of functionalized dialkylchalcogenides

  摘要：

  Alkanethiols, selenols and tellurols are generated in situ by reaction of elemental sulfur, selenium and tellurium with commercial alkyllithiums, followed by reaction with deoxygenated water. The alkanechalcogenols react in situ with activated ole. ns in a Michael- type addition reaction. (c) 2008 Elsevier B. V. All rights reserved.

  DOI：

  10.1016/j.jorganchem.2008.06.014

文献信息

• In Situ Generation of <i>n</i>‐Butanethiol and Its Reaction with Electron‐Deficient Olefines
  作者：Rogério A. Gariani、Alcindo A. Dos Santos、João V. Comasseto

  DOI：10.1080/00397910701820897

  日期：2008.2.13

  n-Butanethiol is generated in situ by sequential addition of n-butyllithium and water to elemental sulfur. The n-butanethiol formed was reacted with electron-deficient olefines to give Michael-type addition products in good yields. The method avoids the manipulation of the bad-smelling n-butanethiol.
• Hydrochalcogenation of activated olefines. Synthesis of functionalized dialkylchalcogenides
  作者：João V. Comasseto、Rogério A. Gariani、Jefferson L. Princival、Alcindo A. Dos Santos、Fabiano K. Zinn

  DOI：10.1016/j.jorganchem.2008.06.014

  日期：2008.8

  Alkanethiols, selenols and tellurols are generated in situ by reaction of elemental sulfur, selenium and tellurium with commercial alkyllithiums, followed by reaction with deoxygenated water. The alkanechalcogenols react in situ with activated ole. ns in a Michael- type addition reaction. (c) 2008 Elsevier B. V. All rights reserved.