Tetramethyl adipoylbisphosphonate | 91009-81-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机膦酸及其衍生物
• 英文名称: Tetramethyl adipoylbisphosphonate
• 英文别名: 1,6-Bis(dimethoxyphosphoryl)hexane-1,6-dione
• CAS: 91009-81-3
• 化学式: C₁₀H₂₀O₈P₂
• 分子量: 330.212
• InChiKey: NGGNDBUMTDTXNB-UHFFFAOYSA-N

物化性质

• 沸点：
  395.6±52.0 °C(Predicted)
• 密度：
  1.262±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -1.1
• 重原子数：
  20
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  105
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为反应物：
  描述：

  Tetramethyl adipoylbisphosphonate 在 磺酰氯 作用下， 以 二氯甲烷 为溶剂， 反应 18.0h， 生成 N,N'-diisopropyl 2,5-dichloro adipoylamide
  参考文献：
  名称：

  Use of acylphosphonates for the synthesis of α-chlorinated carboxylic and α,α′-dichloro dicarboxylic acids and their derivatives

  摘要：

  alpha -Chloro acylphosphonates and alpha,alpha'-dichloro bisacylphosphonates were prepared in situ by chlorination of acylphosphonates and bisacylphosphonates, respectively, using sulfuryl chloride. Subsequently, they were cleaved to the corresponding alpha -chlorinated or alpha,alpha'-dichlorinated (di)carboxylic acids with a hydrogen peroxide-sodium bicarbonate system. Performing the cleavage with an alcohol or an amine yielded the corresponding alpha -chlorinated esters and alpha -chlorinated amides, respectively. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(01)00407-0
• 作为产物：
  描述：

  己二酰氯 、 三甲氧基磷 反应 2.0h， 以97%的产率得到Tetramethyl adipoylbisphosphonate
  参考文献：
  名称：

  Kanaan, Marwan; Burgada, Ramon, Phosphorus and Sulfur and the Related Elements, 1988, vol. 37, p. 217 - 230

  摘要：

  DOI：

文献信息

• In Vitro and In Vivo Anticalcification Effects of Novel Bishydroxyiminophosphonates
  作者：Gershon Golomb、Ada Schlossman、Yael Eitan、Hanan Saadeh、Joel M. Van Gelder、Eli Breuer

  DOI：10.1002/jps.2600811009

  日期：1992.10

  important bone- and/or calcium-related diseases; however, side effects and lack of selectivity impede their wide use. This work reports the synthesis and evaluation of bishydroxyiminophosphonates (e.g., adipoyl- and suberoylbisphosphonate dioximes). These compounds significantly inhibited hydroxyapatite formation and dissolution in vitro and the calcification of bioprosthetic tissue implanted subdermally

  临床上一些双膦酸酯类双膦酸盐可用于许多重要的与骨骼和/或钙有关的疾病。但是，副作用和缺乏选择性阻碍了它们的广泛应用。这项工作报告了双羟基亚氨基膦酸酯（例如，己二酰基和亚磺酰基双膦酸酯二肟）的合成和评估。这些化合物在体外显着抑制羟基磷灰石的形成和溶解以及在大鼠皮下植入的生物修复组织的钙化。本文报道的化合物的活性低于结构相关的双酰基膦酸酯。这项工作的结果表明，在长链双膦酸酯中与膦酸官能团相邻的肟基的引入赋予了钙相互作用能力，并且双膦酸酯的完全可电离性可增强其生物活性。
• SYNTHÈSE ET ÉTUDE STRUCTURALE D′ACIDES DIHYDROXYTÉTRAPHOSPHONIQUES ET DE SELS DE CES ACIDES. 1: SEL DE CUIVRE DE L′ACIDE 1,6-DIHYDROXYHEXYLIDENE-1,1,6,6-TÉTRAPHOSPHONIQUE (DHHTP)
  作者：Habib Khadraoui、Driss El Manouni、Yves Leroux、Alain Neuman、Hélène Gillier、Thierry Prangé、Jean-Paul Silvestre、Nguyen Quy Dao

  DOI：10.1080/10426509608046423

  日期：1996.7.1

  The synthesis of 1,6-bishydroxyhexylidene-1,1,6,6-tetraphosphonic acid (DHHTP, 5) and its copper complex is described. The structure of the copper complex has been determined by X-ray analysis.
• US5338731A
  申请人：——

  公开号：US5338731A

  公开（公告）日：1994-08-16
• Use of acylphosphonates for the synthesis of α-chlorinated carboxylic and α,α′-dichloro dicarboxylic acids and their derivatives
  作者：Christian V Stevens、Bart Vanderhoydonck

  DOI：10.1016/s0040-4020(01)00407-0

  日期：2001.5

  alpha -Chloro acylphosphonates and alpha,alpha'-dichloro bisacylphosphonates were prepared in situ by chlorination of acylphosphonates and bisacylphosphonates, respectively, using sulfuryl chloride. Subsequently, they were cleaved to the corresponding alpha -chlorinated or alpha,alpha'-dichlorinated (di)carboxylic acids with a hydrogen peroxide-sodium bicarbonate system. Performing the cleavage with an alcohol or an amine yielded the corresponding alpha -chlorinated esters and alpha -chlorinated amides, respectively. (C) 2001 Elsevier Science Ltd. All rights reserved.
• Kanaan, Marwan; Burgada, Ramon, Phosphorus and Sulfur and the Related Elements, 1988, vol. 37, p. 217 - 230
  作者：Kanaan, Marwan、Burgada, Ramon

  DOI：——

  日期：——