Dimethyl 3,3'-<(1-methylethylidene)bis(4,1-phenyleneoxy)>bis(2-chloro-2,3,3-trifluoropropionate) | 131043-06-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Dimethyl 3,3'-<(1-methylethylidene)bis(4,1-phenyleneoxy)>bis(2-chloro-2,3,3-trifluoropropionate)
• 英文别名: methyl 2-chloro-3-[4-[2-[4-(2-chloro-1,1,2-trifluoro-3-methoxy-3-oxopropoxy)phenyl]propan-2-yl]phenoxy]-2,3,3-trifluoropropanoate
• CAS: 131043-06-6
• 化学式: C₂₃H₂₀Cl₂F₆O₆
• 分子量: 577.305
• InChiKey: IXZIZJUTZPAKMQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.11
• 重原子数：
  37.0
• 可旋转键数：
  10.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  71.06
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  Dimethyl 3,3'-<(1-methylethylidene)bis(4,1-phenyleneoxy)>bis(2-chloro-2,3,3-trifluoropropionate) 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 反应 0.5h， 以74%的产率得到3,3'-<(1-Methylethylidene)bis(4,1-phenyleneoxy)>bis(2-chloro-2,3,3-trifluoropropanol)
  参考文献：
  名称：

  Fluorinated bifunctional derivatives of bisphenol A

  摘要：

  Bisphenol A reacted as its disodium salt with tetrafluoroethylene and carbon dioxide followed by dimethyl sulfate to give in high yield a symmetrical dimethyl ester assembled from seven structural elements. This diester was transformed into the corresponding diol, diamide, diamine, diisocyanate, and bis(methyl carbamate). Analogous diesters were prepared by using bisphenol A and chlorotrifluoroethylene as well as hexafluorobisphenol A and tetrafluoroethylene. Both of these esters were transformed into other bifunctional derivatives. Catalytic hydrogenation of the diol derived from bisphenol A and tetrafluoroethylene was accompanied by hydrogenolysis of the aryl-oxygen bonds.

  DOI：

  10.1021/jo00001a030
• 作为产物：
  描述：

  三氟氯乙烯 、 二氧化碳 、 bisphenol A disodium salt 、 硫酸二甲酯 生成 Dimethyl 3,3'-<(1-methylethylidene)bis(4,1-phenyleneoxy)>bis(2-chloro-2,3,3-trifluoropropionate)
  参考文献：
  名称：

  Fluorinated bifunctional derivatives of bisphenol A

  摘要：

  Bisphenol A reacted as its disodium salt with tetrafluoroethylene and carbon dioxide followed by dimethyl sulfate to give in high yield a symmetrical dimethyl ester assembled from seven structural elements. This diester was transformed into the corresponding diol, diamide, diamine, diisocyanate, and bis(methyl carbamate). Analogous diesters were prepared by using bisphenol A and chlorotrifluoroethylene as well as hexafluorobisphenol A and tetrafluoroethylene. Both of these esters were transformed into other bifunctional derivatives. Catalytic hydrogenation of the diol derived from bisphenol A and tetrafluoroethylene was accompanied by hydrogenolysis of the aryl-oxygen bonds.

  DOI：

  10.1021/jo00001a030

文献信息

• ARNOLD-STANTON, REGINA;LEMAL, DAVID M., J. ORG. CHEM., 56,(1991) N, C. 146-151
  作者：ARNOLD-STANTON, REGINA、LEMAL, DAVID M.

  DOI：——

  日期：——