4,4'-[1,12-dodecanediylbis(oxy)]bisbenzene | 61575-03-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 4,4'-[1,12-dodecanediylbis(oxy)]bisbenzene
• 英文别名: 1,12-diphenoxy-dodecane；1,12-Diphenoxy-dodecan；α.μ-Diphenoxy-dodecan；Dodekamethylenglykol-diphenylaether；1,1'-[1,12-Dodecanediylbis(oxy)]bisbenzene；12-phenoxydodecoxybenzene
• CAS: 61575-03-9
• 化学式: C₂₄H₃₄O₂
• 分子量: 354.533
• InChiKey: MGDFXJZWAHCAMS-UHFFFAOYSA-N

物化性质

• 熔点：
  85-86 °C
• 沸点：
  464.8±18.0 °C(Predicted)
• 密度：
  0.975±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  26
• 可旋转键数：
  15
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  4,4'-[1,12-dodecanediylbis(oxy)]bisbenzene 在 氢碘酸 作用下， 生成 1,12-二碘十二烷
  参考文献：
  名称：

  v.Braun, Chemische Berichte, 1909, vol. 42, p. 4553

  摘要：

  DOI：
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 乙醚 、 sodium 作用下， 生成 4,4'-[1,12-dodecanediylbis(oxy)]bisbenzene
  参考文献：
  名称：

  v. Braun, Chemische Berichte, 1909, vol. 42, p. 4548

  摘要：

  DOI：

文献信息

• Aromatic formaldehyde condensation polymers as dental plaque barriers
  申请人：Johnson & Johnson Products Inc.

  公开号：EP0105984A1

  公开（公告）日：1984-04-25

  Compositions and methods for preventing the attachment of dental plaque to the surfaces of the teeth of mammals comprise certain aromatic formaldehyde condensation polymers and the pharmaceutically acceptable salts thereof in a pharmaceutically acceptable vehicle, and the periodic application thereof to teeth.

  防止牙菌斑附着在哺乳动物牙齿表面的组合物和方法包括某些芳香族甲醛缩合聚合物及其在药学上可接受的载体中的药学上可接受的盐，以及将其定期涂抹在牙齿上。
• Biological evaluation of bisbenzaldehydes against four Mycobacterium species
  作者：Davie Cappoen、Delphine Forge、Frank Vercammen、Vanessa Mathys、Mehdi Kiass、Virginie Roupie、Roel Anthonissen、Luc Verschaeve、Jean Jacques Vanden Eynde、Kris Huygen

  DOI：10.1016/j.ejmech.2013.03.023

  日期：2013.5

  A series of bisbenzaldehydes and structurally related analogs, conveniently synthesized via microwave-assisted reactions, were evaluated in vitro against drug susceptible and multi-drug resistant Mycobacterium tuberculosis, against virulent Mycobacterium bovis, against Mycobacterium ulcerans and against two Mycobacterium avium subspecies. Among the 33 substances that were tested, compound 12, i.e. 4,4'-[1,12-dodecanediyl(oxy)]bisbenzaldehyde, emerged as the most promising hit. Its activity was further confirmed in an intracellular growth inhibition assay of M. tb in murine J774 A.1 macrophages. None of the compounds showed significant cytotoxicity on human C3A hepatocytes in a neutral red dye uptake assay and no genotoxicity or mutagenicity was observed as demonstrated by a VITOTOX (TM) test and confirmed with a comet assay. (C) 2013 Elsevier Masson SAS. All rights reserved.
• v. Braun; v. Friedrich-Liebenberg, Chemische Berichte, 1937, vol. 70, p. 1598,1601
  作者：v. Braun、v. Friedrich-Liebenberg

  DOI：——

  日期：——
• v.Braun; Sobecki, Chemische Berichte, 1911, vol. 44, p. 1472
  作者：v.Braun、Sobecki

  DOI：——

  日期：——
• FACTORS INFLUENCING THE COURSE AND MECHANISM OF GRIGNARD REACTIONS. XXI. THE REACTION OF HALOALKYL PHENYL ETHERS WITH GRIGNARD REAGENTS IN THE PRESENCE OF COBALTOUS HALIDES
  作者：M. S. KHARASCH、GUIDO STAMPA、WALTER NUDENBERG

  DOI：10.1021/jo01133a014

  日期：1953.5