O,O′,O'',O'''-(1,1′-methylenedinaphthalene-2,7-diyl) tetrakis(dimethylcarbamothioate) | 1357478-94-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: O,O′,O'',O'''-(1,1′-methylenedinaphthalene-2,7-diyl) tetrakis(dimethylcarbamothioate)
• 英文别名: 2,2’,7,7’-tetra(thiocarbamoyl)dinaphthylmethane；O-[8-[[2,7-bis(dimethylcarbamothioyloxy)naphthalen-1-yl]methyl]-7-(dimethylcarbamothioyloxy)naphthalen-2-yl] N,N-dimethylcarbamothioate
• CAS: 1357478-94-4
• 化学式: C₃₃H₃₆N₄O₄S₄
• 分子量: 680.937
• InChiKey: HTOQYBHFSLTZCF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.8
• 重原子数：
  45
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  178
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  O,O′,O'',O'''-(1,1′-methylenedinaphthalene-2,7-diyl) tetrakis(dimethylcarbamothioate) 以 邻二氯苯 为溶剂， 反应 1.0h， 以80%的产率得到S,S′,S'',S'''-(1,1′-methylenedinaphthalene-2,7-diyl) tetrakis(dimethylcarbamothioate)
  参考文献：
  名称：

  Newman–Kwart O→S重排二和四（硫代氨基甲酰基）二萘基甲烷和八（硫代氨基甲酰基）间苯二酚

  摘要：

  在各种条件下，对二硫代和四硫代氨基甲酰基二萘基甲烷和八硫代氨基甲酰基间苯二芳烃进行硫酮-硫醇Newman-Kwart重排。研究了微波辐射和溶剂对反应路径的影响，并证明了控制反应性能的可能性。制备了许多新的环状和无环硫代芳族化合物。

  DOI：

  10.1016/j.tetlet.2015.11.087
• 作为产物：
  描述：

  2,2',7,7'-tetrahydroxydinaphthylmethane 、 二甲氨基硫代甲酰氯 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 生成 O,O′,O'',O'''-(1,1′-methylenedinaphthalene-2,7-diyl) tetrakis(dimethylcarbamothioate)
  参考文献：
  名称：

  二萘甲基甲烷和间苯二酚[4]芳烃的多官能螯合物衍生物：螯合物结构及其受体能力的合成与关系

  摘要：

  摘要 亚甲基双（萘-2-醇/ -2,7-二醇）和rccc-间苯二酚杯[4]芳烃的官能化已在OH基上提供了一系列衍生物，它们分别具有1对，2对或4对螯合离子载体取代基组成给电子原子（O，S，N，P）的组合。通过液体萃取研究了配体的结构特征对其识别和结合过渡金属阳离子（Cd 2 +，Ag +，Hg 2+）的能力的影响。

  DOI：

  10.1134/s1070363220080137

文献信息

• Synthesis of dinaphthylmethane derivatives containing carbamothioyloxy and carbamoylsulfanyl groups
  作者：O. S. Serkova、D. V. Tarasenko、L. K. Vasyanina、O. A. Begmyradova、V. I. Maslennikova、E. E. Nifant’ev

  DOI：10.1134/s1070428014040083

  日期：2014.4

  Chemical modification of 1,1'-methylenedinaphthalen-2-ol and 1,1'-methylenedinaphthalen-2,7-diol, including thiocarbamoylation, Newman-Kwart rearrangement, and hydride reduction, afforded dinaphthylmethane derivatives containing carbamothioyloxy, carbamoylsulfanyl, and sulfanyl groups.
• Complex formation between sulfur-containing dinaphthylmethanes and Pd and Nd salts
  作者：D. V. Tarasenko、O. S. Serkova、I. I. Levina、O. A. Begmyradova、V. I. Maslennikova

  DOI：10.1134/s1070363215100357

  日期：2015.10
• Polyvariant modification of di- and tetrahydroxydinaphthylmethanes
  作者：Vera I. Maslennikova、Olga S. Serkova、Lyudmila V. Shelenkova、Larisa K. Vasyanina、Dmitrii V. Tarasenko、Edward E. Nifantiev

  DOI：10.1016/j.tetlet.2011.12.034

  日期：2012.2

  Modification of di- and tetrahydroxydinaphthylmethanes yielded a new family of aromatic systems differing by the nature, the number, and positions of functional groups and by the mode of fusion of the naphthalene nuclei. The effect of the starting dinaphthylmethane structure on the modification route was demonstrated. (C) 2011 Elsevier Ltd. All rights reserved.
• Polyfunctional Chelate Derivatives of Dinaphthylmethane and Resorcincalix[4]arene: Synthesis and Relationship between Chelate Structure and Its Acceptor Ability
  作者：O. S. Serkova、A. V. Kamkina、I. Yu. Toropygin、V. I. Maslennikova

  DOI：10.1134/s1070363220080137

  日期：2020.8

  methylenebis(naphthalene-2-ol/-2,7-diol) and rccc-resorcincalix[4]arene has given a series of their derivatives at the OH groups with 1, 2, or 4 pairs of chelate ionophore substituents differing in the combination of the constituting electron-donating atoms (O, S , N, P). The effect of the structural features of the ligand on its ability to recognize and bind transition metals cations (Cd2+, Ag+, Hg2+) has been studied

  摘要 亚甲基双（萘-2-醇/ -2,7-二醇）和rccc-间苯二酚杯[4]芳烃的官能化已在OH基上提供了一系列衍生物，它们分别具有1对，2对或4对螯合离子载体取代基组成给电子原子（O，S，N，P）的组合。通过液体萃取研究了配体的结构特征对其识别和结合过渡金属阳离子（Cd 2 +，Ag +，Hg 2+）的能力的影响。
• Newman–Kwart O→S rearrangement of di- and tetra(thiocarbamoyl)dinaphthylmethanes and octa(thiocarbamoyl)resorcinarenes
  作者：Dmitrii V. Tarasenko、Olga S. Serkova、Larisa K. Vasyanina、Vera I. Maslennikova

  DOI：10.1016/j.tetlet.2015.11.087

  日期：2016.1

  thione–thiol Newman–Kwart rearrangement of di- and tetra(thiocarbamoyl)dinaphthylmethanes and octa(thiocarbamoyl)resorcinarenes was performed under various conditions. The effect of microwave irradiation and solvent on the reaction pathway was studied and the possibility of controlling the reaction performance was demonstrated. A number of new cyclic and acyclic thioaromatic compounds were prepared.

  在各种条件下，对二硫代和四硫代氨基甲酰基二萘基甲烷和八硫代氨基甲酰基间苯二芳烃进行硫酮-硫醇Newman-Kwart重排。研究了微波辐射和溶剂对反应路径的影响，并证明了控制反应性能的可能性。制备了许多新的环状和无环硫代芳族化合物。