β-(decylthio)propionitrile | 60372-43-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: β-(decylthio)propionitrile
• 英文别名: 3-decylsulfanylpropionitrile；3-(decylthio)propanenitrile；3-decylmercapto-propionitrile；3-Decylmercapto-propionitril；3-(n-Decylthio)propionitrile；3-decylsulfanylpropanenitrile
• CAS: 60372-43-2
• 化学式: C₁₃H₂₅NS
• 分子量: 227.414
• InChiKey: QQZMCBWMQBFLBP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  15
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  49.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  β-(decylthio)propionitrile 在 sodium hydroxide 、 potassium permanganate 、 溶剂黄146 作用下， 生成 3-(decane-1-sulfonyl)-propionic acid
  参考文献：
  名称：

  Some Long Chain β-Alkylmercaptopropionitriles and their Derivatives

  摘要：

  DOI：

  10.1021/ja01150a536
• 作为产物：
  描述：

  1-癸硫醇 、 丙烯腈 在 三乙胺 作用下， 以 乙醇 为溶剂， 反应 2.0h， 以20 g的产率得到β-(decylthio)propionitrile
  参考文献：
  名称：

  Tanchuk, Yu. V.; Kornienko, A. A., Journal of Organic Chemistry USSR (English Translation), 1980, p. 1367 - 1371

  摘要：

  DOI：

文献信息

• A facile generation of C–S bonds via one-pot, odourless and efficient thia-Michael addition reactions using alkyl, aryl or allyl halides, thiourea and electron-deficient alkenes in wet polyethylene glycol (PEG 200) under mild reaction conditions
  作者：Habib Firouzabadi、Nasser Iranpoor、Mohammad Abbasi

  DOI：10.1016/j.tet.2009.04.079

  日期：2009.7

  An efficient and odourless synthesis of thia-Michael adducts by the reaction of various organic halides (primary, secondary, tertiary, allylic, and benzylic), structurally diverse electron-deficient alkenes (ketones, esters, and acrylonitrile) and thiourea in the presence of sodium carbonate in wet polyethylene glycol (PEG 200) at 30–35 °C has been developed. This protocol is also a highly useful method

  通过在以下条件下，各种有机卤化物（伯，仲，叔，烯丙基和苄基），结构多样的电子缺陷烯烃（酮，酯和丙烯腈）和硫脲的反应，高效而无味地合成噻吩-迈克尔加合物在30–35°C的湿聚乙二醇（PEG 200）中开发了碳酸钠。该协议对于大规模操作也是非常有用的方法。
• Sulfone peroxycarboxylic acids
  申请人：Monsanto Company

  公开号：US05004558A1

  公开（公告）日：1991-04-02

  There are disclosed novel, highly stable sulfone peroxycarboxylic acids useful in detergent compositions or alone as bleaching agents which are represented by the formula ##STR1## wherein A and B are organic moieties bonded to the sulfur atom by a carbon atom and one of A and B contains from 1 to 4 ##STR2## groups bonded to carbon atoms.

  揭示了一种新型、高度稳定的磺酰过氧羧酸，可用于洗涤剂组合物或单独用作漂白剂，其化学式表示为##STR1##其中A和B是有机基团，通过碳原子与硫原子相连接，其中A和B中的一个含有1至4个##STR2##基团，与碳原子相连接。
• Pronounced Catalytic Effect of a Micellar Solution of Sodium Dodecyl Sulfate (SDS) on the Efficient C-S Bond Formation<i>via</i>an Odorless Thia-Michael Addition Reaction through the<i>in situ</i>Generation of<i>S</i>-Alkylisothiouronium Salts
  作者：Habib Firouzabadi、Nasser Iranpoor、Mohammad Abbasi

  DOI：10.1002/adsc.200800690

  日期：2009.3

  Abstractmagnified imageA pronounced catalytic effect of sodium dodecyl sulfate (SDS) was observed on thein situproduction ofS‐alkylisothiouronium saltsviathe reaction of primary, allyl and benzyl halides with thiourea in SDS droplets .Hydrolysis of the generatedS‐alkylisothiouronium salts in the palisade layer of the droplets produces the corresponding thiol moieties which are immediately added to the electron‐deficient olefins that are present in the micellar core to produce the thia‐Michael adducts. The entire route is an almost odorless process. The yields of the products are good to excellent and the method is applicable to large‐scale operation without any problem.
• US4758369A
  申请人：——

  公开号：US4758369A

  公开（公告）日：1988-07-19
• US4824591A
  申请人：——

  公开号：US4824591A

  公开（公告）日：1989-04-25