1,3,5,7-tetramethyl-2,4,8-trioxa-6-(o-methoxyphenyl)-6-phosphaadamantane

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1,3,5,7-tetramethyl-2,4,8-trioxa-6-(o-methoxyphenyl)-6-phosphaadamantane
• 英文别名: 1,3,5,7-tetramethyl-6-(2-methoxyphenyl)-2,4,8-trioxa-6-phosphaadamantane；8-(2-Methoxyphenyl)-1,3,5,7-tetramethyl-2,4,6-trioxa-8-phosphatricyclo[3.3.1.13,7]decane；8-(2-methoxyphenyl)-1,3,5,7-tetramethyl-2,4,6-trioxa-8-phosphatricyclo[3.3.1.13,7]decane
• 化学式: C₁₇H₂₃O₄P
• 分子量: 322.341
• InChiKey: HFTPNSJZRPBAAW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  36.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-溴苯甲醚 、 2,4,6-三氧杂-1,3,5,7-四甲基-8-磷杂金刚烷 在 四(三苯基膦)钯 、 potassium carbonate 作用下， 以 xylene 为溶剂， 反应 20.0h， 以79%的产率得到1,3,5,7-tetramethyl-2,4,8-trioxa-6-(o-methoxyphenyl)-6-phosphaadamantane
  参考文献：
  名称：

  磷金刚烷类作为钯催化的交叉偶联化学的配体：铃木偶联的卤代烃和含β-氢的甲苯磺酸酯与硼酸和炔烃的铃木偶联中的文库合成，表征和筛选

  摘要：

  通过1,3,5,7-四甲基-2,4,8-三氧杂-6-磷酸金刚烷的P-芳基化反应制备了磷金刚烷配体的15元文库。对该叔膦收集物的筛选可以快速确定最合适的配体，特别是1,3,5,7-四甲基-6-（2,4-二甲氧基苯基）-2,4,8-三氧杂-6-磷酸金刚烷，用于促进含β-氢的烷基卤或甲苯磺酸酯与硼酸或烷基硼烷的铃木型偶联。

  DOI：

  10.1021/jo048875+
• 作为试剂：
  描述：

  4-碘甲苯 、 1-((4-甲氧基苯基)甲基)-1H-吡咯-2,5-二酮 在 tris(dibenzylideneacetone)dipalladium(0) chloroform complex 、 N-甲基二环己基胺 、 1,3,5,7-tetramethyl-2,4,8-trioxa-6-(o-methoxyphenyl)-6-phosphaadamantane 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 0.92h， 以55%的产率得到1-(4-methoxybenzyl)-3,4-di-p-tolyl-1H-pyrrole-2,5-dione
  参考文献：
  名称：

  Development of Methods for the Synthesis of Libraries of Substituted Maleimides and α,β-Unsaturated-γ-butyrolactams

  摘要：

  Synthetic methods for the preparation of maleimide and alpha,beta-unsaturated-gamma-butyrolactam compound collections are described. These routes take advantage of Pd cross-coupling and conjugate addition/elimination reactions to permit the facile production of bisaryl-maleimides, anilinoaryl-maleimides, and bisanilino-maleimides while allowing control over the synthesis of symmetrical or nonsymmetrical derivatives. Similarly, the chemistry developed allows for the generation of bisaryl substituted alpha,beta-unsaturated-gamma-butyrolactams. The scope and limitations of the approaches are presented.

  DOI：

  10.1021/jo1025805

文献信息

• Butadiene telomerization catalyst precursor preparation
  申请人：Dow Global Technologies LLC

  公开号：US10569262B2

  公开（公告）日：2020-02-25

  Use a solvent blend that contains 1-methoxy-2,7-octadiene and an alkanols rather than the alkanols by itself to prepare a catalyst precursor suitable for use in butadiene telomerization.

  使用含有 1-甲氧基-2,7-辛二烯和烷醇而非烷醇本身的混合溶剂来制备适用于丁二烯端聚合反应的催化剂前体。
• Butadiene telomerization catalyst and preparation thereof
  申请人：Dow Global Technologies LLC

  公开号：US11312670B2

  公开（公告）日：2022-04-26

  Catalyst compositions are prepared by contacting a palladium source and 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaadamantane and a methoxyocta-diene compound, in a primary aliphatic alcohol, under suitable conditions including a ratio of equivalents of palladium to equivalents of 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaadamantane ranging from greater than 1:1 to 1:1.3. The result is a complex of palladium, a 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaada-mantane ligand, and a ligand selected from a methoxyoctadiene ligand, an octadienyl ligand, or a protonated octadienyl. Such complexes may, in solution, exhibit surprising solubility and storage stability and are useful in the telomerization of butadiene, which is a step in the production of 1-octene.

  催化剂组合物的制备方法是将钯源和 1,3,5,7-四甲基-6-(2,4-二甲氧基苯基)-2,4,8-三氧杂-6-磷杂金刚烷以及甲氧基辛二烯化合物在一级脂肪醇中接触、在适当的条件下，包括钯的当量与 1，3，5，7-四甲基-6-(2，4-二甲氧基苯基)-2，4，8-三氧杂-6-磷杂金刚烷的当量之比大于 1：1 至 1:1。3.结果是一种钯、1,3,5,7-四甲基-6-(2,4-二甲氧基苯基)-2,4,8-三氧杂-6-磷杂金刚烷配体和选自甲氧基辛二烯配体、辛二烯配体或质子化辛二烯配体的络合物。这种复合物在溶液中可以表现出惊人的溶解性和贮存稳定性，可用于丁二烯的端聚反应，这是生产 1-辛烯的一个步骤。
• BUTADIENE TELOMERIZATION CATALYST PRECURSOR PREPARATION
  申请人：Dow Global Technologies LLC

  公开号：EP3080136B1

  公开（公告）日：2020-10-28
• BUTADIENE TELOMERIZATION CATALYST AND PREPARATION THEREOF
  申请人：Dow Global Technologies LLC

  公开号：EP3280690A1

  公开（公告）日：2018-02-14
• BUTADIENE TELOMERIZATION CATALYST PREPARATION AND USE THEREOF
  申请人：Dow Global Technologies LLC

  公开号：US20220213006A1

  公开（公告）日：2022-07-07

  Catalyst compositions are prepared by contacting a palladium source and 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaadamantane and a methoxyocta-diene compound, in a primary aliphatic alcohol, under suitable conditions including a ratio of equivalents of palladium to equivalents of 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaadamantane ranging from greater than 1:1 to 1:1.3. The result is a complex of palladium, a 1,3,5,7-tetramethyl-6-(2,4-dimethoxyphenyl)-2,4,8-trioxa-6-phosphaada-mantane ligand, and a ligand selected from a methoxyoctadiene ligand, an octadienyl ligand, or a protonated octadienyl. Such complexes may, in solution, exhibit surprising solubility and storage stability and are useful in the telomerization of butadiene, which is a step in the production of 1-octene.