1-(bis(pentylthio)methyl)benzene | 21055-99-2

• 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-(bis(pentylthio)methyl)benzene
• 英文别名: [Bis(pentylsulfanyl)methyl]benzene；bis(pentylsulfanyl)methylbenzene
• CAS: 21055-99-2
• 化学式: C₁₇H₂₈S₂
• 分子量: 296.541
• InChiKey: USAUSRMINOVIMH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.7
• 重原子数：
  19
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  50.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(bis(pentylthio)methyl)benzene 、 过氧化苯甲酰 以 四氯化碳 为溶剂， 生成 苯甲酸
  参考文献：
  名称：

  Reaction of benzoyl peroxide with thioacetals

  摘要：

  DOI：

  10.1007/bf00948637
• 作为产物：
  描述：

  1-戊硫醇 、 苯甲醛 在 graphene oxide 作用下， 以 neat (no solvent) 为溶剂， 反应 5.0h， 以91%的产率得到1-(bis(pentylthio)methyl)benzene
  参考文献：
  名称：

  Graphene oxide (GO)-catalyzed chemoselective thioacetalization of aldehydes under solvent-free conditions

  摘要：

  An efficient method for the synthesis of open chain, cyclic, and unsymmetrical dithioacetals from aryl/hetero-aryl/aliphatic aldehydes is described. The reaction is performed using graphene oxide (GO) as the catalyst under solvent-free and aerobic conditions. High chemoselectivity is observed in the reaction as aryl/alkyl ketones do not give thioketals under the condition. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.10.043

文献信息

• Dithioacetal Exchange: A New Reversible Reaction for Dynamic Combinatorial Chemistry
  作者：A. Gastón Orrillo、Andrea M. Escalante、Ricardo L. E. Furlan

  DOI：10.1002/chem.201600208

  日期：2016.5.10

  Reversibility of dithioacetal bond formation is reported under acidic mild conditions. Its utility for dynamic combinatorial chemistry was explored by combining it with orthogonal disulfide exchange. In such a setup, thiols are positioned at the intersection of both chemistries, constituting a connecting node between temporally separated networks.

  据报道在酸性温和条件下二硫缩醛键形成的可逆性。通过将其与正交二硫键交换相结合，探索了其在动态组合化学中的用途。在这样的设置中，硫醇位于两种化学的相交处，构成在时间上分离的网络之间的连接节点。
• Puzin, Yu. I.; Leplyanin, G. V.; Spirikhin, L. V., Doklady Chemistry, 1984, vol. 279, p. 422 - 426
  作者：Puzin, Yu. I.、Leplyanin, G. V.、Spirikhin, L. V.、Parmenova, I. P.、Muslukhov, R. M.、Tolstikov, G. A.

  DOI：——

  日期：——
• Graphene oxide (GO)-catalyzed chemoselective thioacetalization of aldehydes under solvent-free conditions
  作者：Babli Roy、Debasish Sengupta、Basudeb Basu

  DOI：10.1016/j.tetlet.2014.10.043

  日期：2014.11

  An efficient method for the synthesis of open chain, cyclic, and unsymmetrical dithioacetals from aryl/hetero-aryl/aliphatic aldehydes is described. The reaction is performed using graphene oxide (GO) as the catalyst under solvent-free and aerobic conditions. High chemoselectivity is observed in the reaction as aryl/alkyl ketones do not give thioketals under the condition. (C) 2014 Elsevier Ltd. All rights reserved.
• Reaction of benzoyl peroxide with thioacetals
  作者：Yu. I. Puzin、G. V. Leplyanin、S. R. Rafikov

  DOI：10.1007/bf00948637

  日期：1984.9