3,3,7,7,11,11,15,15-Octamethyl-5,9,13-trithia-tricyclo[8.5.0.0^2,8]pentadeca-1(10),2(8)-diene | 126036-33-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 英文名称: 3,3,7,7,11,11,15,15-Octamethyl-5,9,13-trithia-tricyclo[8.5.0.0^2,8]pentadeca-1(10),2(8)-diene
• 英文别名: 3,3,7,7,11,11,15,15-Octamethyl-5,9,13-trithiatricyclo[8.5.0.02,8]pentadeca-1(10),2(8)-diene；3,3,7,7,11,11,15,15-octamethyl-5,9,13-trithiatricyclo[8.5.0.02,8]pentadeca-1(10),2(8)-diene
• CAS: 126036-33-7
• 化学式: C₂₀H₃₂S₃
• 分子量: 368.672
• InChiKey: YPEOUCVVYMJOGT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.1
• 重原子数：
  23
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  78.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3,3,7,7,11,11,15,15-Octamethyl-5,9,13-trithia-tricyclo[8.5.0.0^2,8]pentadeca-1(10),2(8)-diene 在 镍 作用下， 以53%的产率得到噻吩,四(1,1-二甲基乙基)-
  参考文献：
  名称：

  Tetra-tert-butylpyrazole and tetra-tert-butylthiophene

  摘要：

  Tetra-tert.butylpyrazole (4) and tetra-tert.butylthiophene (11) were prepared starting from the seven membered cycloalkyne 1 and a reductive desulfurization in the last step. Some reactions of 4 and 11 are described. X-ray structural analyses of 11 and the corresponding S,S-dioxide were carried out.

  DOI：

  10.1016/s0040-4039(00)61096-1
• 作为产物：
  描述：

  (3,3,6,6-tetramethylthiepane-4,5-diylidene)bis(hydrazine) 在 二氯化二硫 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 3,3,7,7,11,11,15,15-Octamethyl-5,9,13-trithia-tricyclo[8.5.0.0^2,8]pentadeca-1(10),2(8)-diene
  参考文献：
  名称：

  Tetra-tert-butylpyrazole and tetra-tert-butylthiophene

  摘要：

  Tetra-tert.butylpyrazole (4) and tetra-tert.butylthiophene (11) were prepared starting from the seven membered cycloalkyne 1 and a reductive desulfurization in the last step. Some reactions of 4 and 11 are described. X-ray structural analyses of 11 and the corresponding S,S-dioxide were carried out.

  DOI：

  10.1016/s0040-4039(00)61096-1

文献信息

• Nicolaou; DeFrees; Hwang, Journal of the American Chemical Society, 1990, vol. 112, # 8, p. 3029 - 3039
  作者：Nicolaou、DeFrees、Hwang、Stylianides、Carroll、Snyder

  DOI：——

  日期：——
• Tetra-tert-butylpyrazole and tetra-tert-butylthiophene
  作者：Adolf W. Krebs、Erhard Franken、Michael Müller、Horst Colberg、Walter Cholcha、Jörg Wilken、Jörg Ohrenberg、Reinhard Albrecht、Erwin Weiss

  DOI：10.1016/s0040-4039(00)61096-1

  日期：1992.9

  Tetra-tert.butylpyrazole (4) and tetra-tert.butylthiophene (11) were prepared starting from the seven membered cycloalkyne 1 and a reductive desulfurization in the last step. Some reactions of 4 and 11 are described. X-ray structural analyses of 11 and the corresponding S,S-dioxide were carried out.