N-tert-butyl-1,5,3-dithiazocane | 1376771-63-9

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: N-tert-butyl-1,5,3-dithiazocane
• 英文别名: 3-tert-butyl-1,5,3-dithiazocane；N-t-butyl-1,5,3-dithiazocane
• CAS: 1376771-63-9
• 化学式: C₉H₁₉NS₂
• 分子量: 205.389
• InChiKey: RABLMVHABSKFHO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  53.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N-tert-butyl-1,5,3-dithiazocane 、 甲氧苯胺 在 samarium(III) nitrate hexahydrate 作用下， 以 氯仿 为溶剂， 反应 3.0h， 生成 3-(4-methoxyphenyl)-1,5,3-dithiazocane
  参考文献：
  名称：

  Synthesis of N-aryl-1,5,3-dithiazepanes and N-aryl-1,5,3-dithiazocanes in the presence of samarium- and cobalt-containing catalysts

  摘要：

  Efficient procedures were developed for the synthesis of N-aryl-1,5,3-dithiazepanes and N-aryl-1,5,3-dithiazocanes by cyclocondensation of anilines with formaldehyde and alpha,omega-dithiols (etane-1,2-dithiol and propane-1,3-dithiol), as well as by transamination of N-tert-butyl-1,5,3-dithiazepane or N-tert-butyl-1,5,3-dithiazocane with aromatic amines in the presence of samarium and cobalt complexes.

  DOI：

  10.1134/s1070428012040215

文献信息

• Synthesis of N-(1,5,3-dithiazepan-3-yl)- and N-(1,5,3-dithiazocan-3-yl)amides in the presence of lanthanide catalysts
  作者：R. R. Khairullina、B. F. Akmanov、Z. A. Starikova、A. G. Ibragimov、U. M. Dzhemilev

  DOI：10.1134/s1070428013110213

  日期：2013.11

  A new method was developed for preparation of N-(1,5,3-dithiazepan-5-yl)- and N-(1,5,3-dithiazocan-5-yl)amides by transamination of N-tert-butyl-1,5,3-dithiazepane and N-tert-butyl-1,5,3-dithiazocane, and also by recyclization of 1-oxa-3,6-dithiacycloheptane and 1-oxa-3,7-dithiacyclooctane with carboxylic acids hydrazides in the presence of catalysts based on rare earth elements.
• Hydrazines in the synthesis of N-substituted 1,5,3-dithiazocan-3-amines catalyzed by Ti and Cu compounds
  作者：N. N. Makhmudiyarova、K. I. Prokof’ev、L. V. Mudarisova、A. G. Ibragimov、U. M. Dzhemilev

  DOI：10.1134/s1070428013050023

  日期：2013.5

  Efficient preparation method was developed for N-aryl(benzyl, alkyl)-1,5,3-dithiazocan-3-amines consisting in the transamination of 3-tert-butyl-1,5,3-dithiazocane with aryl(benzyl)hydrazines, and also in the reaction of N (1),N (1),N (7),N (7)-tetramethyl-2,6-dithiaheptane-1,7-diamine with aryl(benzyl, alkyl)hydrazines in the presence of catalytic amounts of Ti and Cu compounds.