1,2,6,7-tetrahydrobenzo[f][1,3,5,8]dithiadiazonine | 1266077-65-9

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1,2,6,7-tetrahydrobenzo[f][1,3,5,8]dithiadiazonine
• 英文别名: 1,2,6,7-tetrahydro-3,5,1,7-benzodithiadiazonine
• CAS: 1266077-65-9
• 化学式: C₉H₁₂N₂S₂
• 分子量: 212.34
• InChiKey: XLPVLSQILODJPR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  74.7
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  邻苯二胺 、 1,3,5-三噻烷 在 iron(III) chloride hexahydrate 作用下， 以 乙腈 为溶剂， 反应 6.0h， 以67%的产率得到1,2,6,7-tetrahydrobenzo[f][1,3,5,8]dithiadiazonine
  参考文献：
  名称：

  Effective synthesis of N-substituted 1,3,5-dithiazinanes by reactions of N-methyl-1,3,5-dithiazinane and 1,3,5-trithiane with aromatic amines

  摘要：

  A novel procedure has been developed for selective synthesis of N-aryl-1,3,5-dithiazinanes, 1,2,6,7-tetrahydro-3,5,1,7-benzodithiadiazonine, and 6,7-dihydro-1,3,5,7-benzotrithiazonine by reactions of aniline derivatives with N-methyl-1,3,5-dithiazinane or 1,3,5-trithiane in the presence of transition and rare earth metal salts and complexes.

  DOI：

  10.1134/s1070428011090065

文献信息

• Efficient method for a synthesis of N-substituted dithiazinanes via transamination of N-methyl-1,3,5-dithiazinane with arylamines and hydrazines
  作者：Zalifa T. Niatshina、Natal’ya N. Murzakova、Inna V. Vasilieva、Elena B. Rakhimova、Vnira R. Akhmetova、Askhat G. Ibragimov

  DOI：10.3998/ark.5550190.0012.810

  日期：——

  The efficient method for a synthesis of N-substituted dithiazinanes based on the transamination reaction of N-methyl-1,3,5-dithiazinane with arylamines and hydrazines in the presence of Sm and Co catalysts has been developed.

  已经开发了基于 N-甲基-1,3,5-二噻嗪烷与芳胺和肼在 Sm 和 Co 催化剂存在下的氨基转移反应合成 N-取代二噻嗪烷的有效方法。
• Phenylenediamine and 4,4′-diaminodiphenyls in cyclothiomethylation with CH2O and H2S
  作者：G. R. Khabibullina、V. R. Akhmetova、R. V. Kunakova

  DOI：10.1134/s107036321404015x

  日期：2014.4

  Cyclothiomethylation of o-phenylenediamine with CH2O and H2S gives rise to 1,2,4,5-tetrahydrobenzo[d][1,3,6]thiadiazepine and 1,2,6,7-tetrahydrobenzo[f][1,3,5,8]dithiadiazonine, whereas m-phenylenediamine forms benzothiaza macroheterocycles of various structure, comprising 4-8 molecules of the starting diamine, formaldehyde, and hydrogen sulfide. 4,4'-Diaminodiphenyls give bis(1,3,5-dithiazinanes), along with oligomeric hetero(N,S,O)atomic compounds.