1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-S,S' | 52559-80-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-S,S'
• 英文别名: 1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane；1,4-dithia-18-crown-6；1,4,7,10-tetraoxa-13,16-dithia-cyclooctadecane；1,4-Dithia-(18-Krone-6)
• CAS: 52559-80-5
• 化学式: C₁₂H₂₄O₄S₂
• 分子量: 296.452
• InChiKey: YPWJPPTWZSDQOY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  18
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  87.5
• 氢给体数：
  0
• 氢受体数：
  6

安全信息

• 海关编码：
  2934999090

反应信息

• 作为反应物：
  描述：

  1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-S,S' 、 phenylthallium(III) oxide 以 高氯酸 为溶剂， 以80%的产率得到phenylthallium(III) (1,4-dithia-7,10,13,16-tetraoxacyclooctadecane)diperchlorate
  参考文献：
  名称：

  苯并lium（III）冠醚配合物对苯酚及其衍生物的亲电子缩合反应

  摘要：

  The reaction of [phenylthallium(III)(18-crown-6)] diperchlorate, [PhTl(III)(18-crown-6)](ClO4)2 (1a), with phenol gives [phenyl(4'-hydroxyphenyl)thallium(III)(18-crown-6)] perchlorate (2), the phenolic OH having remained intact. The complex 1a reacts also with alkylphenols, methoxyphenols, catechol, resorcinol, and pyrogallol to give thallated products exclusively at the para position of the electron-donating group (OH or OCH3) without suffering from reduction of thallium(III). No reaction takes place with benzene, toluene, and tert-butylbenzene.

  DOI：

  10.1021/om00052a063

文献信息

• Synthesis and characterisation of palladium(<scp>II</scp>) complexes of mixed thioether/oxa ionophores. Crystal structures of [PdCl₂([18]aneS₂O₄)], [Pd([18]aneS₂O₄)₂][PF₆]₂([18]aneS₂O₄= 1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane) and [Pd([18]aneS₃O₃)₂][PF₆]₂([18]aneS₃O₃= 1,4,7-trioxa-10,13,16-trithiacyclooctadecane)
  作者：Alexander J. Blake、Robert O. Gould、Christian Radek、Martin Schröder

  DOI：10.1039/dt9950004045

  日期：——

  Cl(2)–Pd–S(4) 179.24(4) and S(1)–Pd–S(4) 88.96(4)°. The near-planar macrocycle co-ordinates as a bidentate chelating ligand via the exo oriented S-donor atoms leaving the endo oriented O atoms free. The SCH2CH2S moiety adopts a gauche conformation [S(1)–C(2)–C(3)–S(4)–58.3(4)°] with the ethylene bridge occupying part of the macrocyclic cavity. The crystal structure of [Pd([18]aneS2O4)2][PF6]2 showed

  钯（II）配合物顺式-[PdCl 2（[18] aneS 2 O 4）]，[Pd（[18] aneS 2 O 4）2 ] [PF 6 ] 2（[18] aneS 2 O 4 = 1 ，4,7,10-四氧杂-13,16-二硫代环十八烷），[Pd（[18] aneS 3 O 3）2 ] [PF 6 ] 2（[18] aneS 3 O 3 = 1,4,7-三ox杂-10,13,16-三硫代环十八烷）和[PdCl（[20] aneS 3 O 3）] BPh 4（[20] aneS 3已经合成并表征了O 3＝ 1,4,7-三氧杂-10,14,18-三硫代环二十烷。PdCl 2与1摩尔当量的[18] aneS 2 O 4反应，得到顺式-[PdCl 2（[18] aneS 2 O 4）]。加入第二当量得到双络合物阳离子[Pd（[18] aneS 2 O 4）2 ] 2+。顺式-[PdCl 2（[18] aneS
• The synthesis and single-crystal X-ray structure of the tetranuclear silver(<scp>I</scp>) complex {[Ag₂([18]aneS₂O₄)₂]₂}(PF₆)₄([18]aneS₂O₄= 1,4,7, 10-tetraoxa-13, 16-dithiacyclooctadecane)
  作者：Alexander J. Blake、Robert O. Gould、Christian Radek、Martin Schröder

  DOI：10.1039/c39940000985

  日期：——

  Reaction of AgNO3 with [18]aneS2O4([18]aneS2O4= 1,4,7,10-tetraoxa-13, 16-dithiacyclooctadecane) affords a 1 : 1 complex, the single-crystal X-ray structure of which confirms the formation of binuclear [Ag2([18]aneS2O4)2]2+ dications; these dications are linked in pairs by a long S ⋯ S interaction to give an overall tetranuclear structure.

  AgNO3 与 [18]aneS2O4 （[18]aneS2O4= 1,4,7,10-四氧杂-13,16-二硫杂环十八烷）反应生成 1 : 1 复合物，其单晶 X 射线结构证实了双核 [Ag2([18]aneS2O4)2]2+ 二阳离子的形成；这些二阳离子通过长 S ⋯ S 相互作用成对连接，从而形成整体四核结构。
• LITHIUM ION BATTERY SEPARATORS AND ELECTRODES
  申请人：GM GLOBAL TECHNOLOGY OPERATIONS LLC

  公开号：US20150093626A1

  公开（公告）日：2015-04-02

  A lithium ion battery separator includes a porous film of a polymeric chelating agent. The polymeric chelating agent includes a poly(undecylenyl-macrocycle), where the macrocycle is a chelating agent. A positive electrode includes a structure and a coating formed on a surface of the structure. The structure includes a lithium transition metal based active material, a binder, and a conductive carbon; and the coating includes a poly(undecylenyl-macrocycle), where the macrocycle is a chelating agent. The separator and/or positive electrode are suitable for use in a lithium ion battery.

  一种锂离子电池隔膜包括一种聚合物螯合剂的多孔膜。该聚合物螯合剂包括一种聚(十一烯基-大环) ，其中大环是一种螯合剂。正极包括一个结构和形成在结构表面上的涂层。该结构包括一种锂过渡金属基活性材料、一个粘结剂和一个导电碳；而涂层包括一种聚(十一烯基-大环)，其中大环是一种螯合剂。该隔膜和/或正极适用于锂离子电池。
• Tris(1,4,7,10-tetraoxa-13,16-dithiacyclooctadecane-S,S')ruthenium(II) Bis(hexafluorophosphate)–Water–Methanol (1/2/1)
  作者：A. J. Blake、C. Radek、M. Schröder

  DOI：10.1107/s0108270196001497

  日期：1996.6.15

  In the title complex, [Ru(C12H24O4S2)(3)](PF6)(2).2H(2)O.CH3OH, the Ru-II ion lies on a crystallographic threefold axis and is coordinated to three symmetry-equivalent macrocyclic ligands via their S donor atoms [Ru-S 2.3620 (9) and 2.3859 (9) Angstrom]. The macrocycle adopts a typical bidentate chelating coordination mode with S donors in exo and O donors in endo orientations.
• Structure of dichloro(1,4,7,10-tetraoxa-13,16-dithiacylooctadecane-S,S')mercury(II)–mercury dichloride
  作者：N. K. Dalley、S. B. Larson

  DOI：10.1107/s0567740881008455

  日期：1981.12.15