N-methyl-4,5-ethylenedithio-1,3-thiazol-2-thione | 917078-03-6

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: N-methyl-4,5-ethylenedithio-1,3-thiazol-2-thione
• 英文别名: 3-Methyl-5,6-dihydro-[1,4]dithiino[2,3-d][1,3]thiazole-2-thione；3-methyl-5,6-dihydro-[1,4]dithiino[2,3-d][1,3]thiazole-2-thione
• CAS: 917078-03-6
• 化学式: C₆H₇NS₄
• 分子量: 221.392
• InChiKey: FRBTZOWEWJKCBT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  111
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-methyl-4,5-ethylenedithio-1,3-thiazol-2-thione 在 氢氧化钾 、 hexafluorophosphoric acid 、 双氧水 、 氧气 作用下， 生成 cyclodiazecinedione
  参考文献：
  名称：

  1,3-Thiazoline-2-thione-4,5-dithiolato, an efficient building block towards functionalized dithiadiazafulvalenes

  摘要：

  The first synthesis and X-ray structural determination of the bis(tetraethylammonium) Zn dithiolene complex involving N-methyl-1,3-thiazoline-2-thione-4,5-dithiolate, [NEt4](2)[Zn(Me-thiazdt)(2)], are reported. The reactivity of this dithiolene complex as a nucleophilic dithiolate synthon and as a precursor of the air sensitive electron rich olefine, the his ethylenedithiodithiadiazafulvalene (BEDT-DTDAF), is also described. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.09.079
• 作为产物：
  描述：

  1,2-二溴乙烷 、 3-甲基-2(3H)-噻唑硫酮 在 1,2,3,4,5,6,7,8-八硫杂环辛烷 、 lithium diisopropyl amide 、 四乙基溴化铵 、 zinc(II) chloride 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 反应 15.0h， 生成 N-methyl-4,5-ethylenedithio-1,3-thiazol-2-thione
  参考文献：
  名称：

  1,3-Thiazoline-2-thione-4,5-dithiolato, an efficient building block towards functionalized dithiadiazafulvalenes

  摘要：

  The first synthesis and X-ray structural determination of the bis(tetraethylammonium) Zn dithiolene complex involving N-methyl-1,3-thiazoline-2-thione-4,5-dithiolate, [NEt4](2)[Zn(Me-thiazdt)(2)], are reported. The reactivity of this dithiolene complex as a nucleophilic dithiolate synthon and as a precursor of the air sensitive electron rich olefine, the his ethylenedithiodithiadiazafulvalene (BEDT-DTDAF), is also described. (c) 2006 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2006.09.079

文献信息

• 1,3-Thiazoline-2-thione-4,5-dithiolato, an efficient building block towards functionalized dithiadiazafulvalenes
  作者：Samar Eid、Michel Guerro、Dominique Lorcy

  DOI：10.1016/j.tetlet.2006.09.079

  日期：2006.11

  The first synthesis and X-ray structural determination of the bis(tetraethylammonium) Zn dithiolene complex involving N-methyl-1,3-thiazoline-2-thione-4,5-dithiolate, [NEt4](2)[Zn(Me-thiazdt)(2)], are reported. The reactivity of this dithiolene complex as a nucleophilic dithiolate synthon and as a precursor of the air sensitive electron rich olefine, the his ethylenedithiodithiadiazafulvalene (BEDT-DTDAF), is also described. (c) 2006 Elsevier Ltd. All rights reserved.