1,3-bis(diphenylphosphinoacetyl)benzene | 136905-05-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1,3-bis(diphenylphosphinoacetyl)benzene
• 英文别名: 2-Diphenylphosphanyl-1-[3-(2-diphenylphosphanylacetyl)phenyl]ethanone
• CAS: 136905-05-0
• 化学式: C₃₄H₂₈O₂P₂
• 分子量: 530.543
• InChiKey: NQDNXPDXZIAHJT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  38
• 可旋转键数：
  10
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  {(C5Ph5)Ni(CO)Br} 、 1,3-bis(diphenylphosphinoacetyl)benzene 在 1,8-bis(dimethylamino)naphthalene 、 CH₂Cl₂ 作用下， 以 二氯甲烷 为溶剂， 以69%的产率得到{(nickel(II)(η5-(pentaphenyl)cyclopentadienyl))2((C6H5)2PCHC(O)(1,3-C6H4)C(O)HCP(C6H5)2)}*0.25dichloromethane
  参考文献：
  名称：

  具有杂功能化膦配体的镍配合物。乙烯与[Ni（C 5 Ph 5）{Ph 2 PCHC（O）Ph}]的催化低聚

  摘要：

  [Ni（C 5 Ph 5）Br（CO）]与Ph 2 PCH 2 C（O）Ph在1,8-双（二​​甲基氨基）萘（质子海绵）存在下的反应得到螯合物[Ni（C 5 Ph 5）{Ph 2 PCH C（O）Ph}] 1。配合物[Ni（C 5 Ph 5）{Ph 2 PCH C（O）（C 5 H 4）Fe（C 5 H 5）}] 2，[Ni（C 5 Ph 5）{Ph 2 PCH C（O ）（1,3-C 6 H 4）C（O）HCPPh 2 } Ni（C 5 Ph 5）] 3，[Ni（C 5 H 5）{Ph 2 PCH C（O）Ph}] 4和[Ni（C 5 H 5）{Ph 2 PCH C（O） （C 5 H 4）Fe（C 5 H 5）}] 5已使用适当的膦配体并采用与1相似的方法合成。配合物1，被NaBH 4激活在乙烯的低压低聚中表现出催化活性。在130°C和38 bar的乙烯压力下，对线性α-烯烃的选择性高达98％。用HBF

  DOI：

  10.1039/dt9930001173

文献信息

• Convenient synthesis of new binucleating ligands derived from 1,3-diacetylbenzene. Possible precursors for oligomeric organometallic materials
  作者：Dominique Matt、Alain Van Dorsselaer

  DOI：10.1016/s0277-5387(00)86075-1

  日期：1991.1

  Bis-phosphine 1,3-bis(diphenylphosphinoacetyl)benzene (LH2) is obtained in high yield by reacting Ph2PCl with bis(lithium anolate) derived from 1,3-diacetylbenzene in tetrahydrofuran. Its oxidation by air gives quantitatively the corresponding double beta-ketophosphine oxide. The ligand LH2 reacts with [(omicron-C6H4CH2NMe2)PdCl]2 to give the binuclear complex [(omicron-C6H4CH2NMe2)PdCl}2(mu-LH2)] in which the bis-phosphine behaves as a bridging ligand. The latter complex is conveniently converted by prolonged treatment with sodium hydride in tetrahydrofuran into the bis-enalto complex [(omicron-C6H4CH2NMe2)Pd}2(mu-L)] in which the bridging ligand L contains two chelating subunits. Reaction of LH2 with [Pd(acac)2] leads to oligomeric material of formula (PdL)n. Mass spectroscopic measurements suggest the presence of a tetrameric species, (PdL)4, present in the reaction mixture.
• Nickel complexes with heterofunctionalized phosphine ligands. Catalytic oligomerization of ethylene with [Ni(C₅Ph₅){Ph₂PCHC(O)Ph}]
  作者：Dominique Matt、Michael Huhn、Jean Fischer、André De Cian、Wolfgang Kläui、Igor Tkatchenko、Michel C. Bonnet

  DOI：10.1039/dt9930001173

  日期：——

  bar of ethylene, selectivities of up to 98% towards linear α-olefins were achieved. Protonation of the bimetallic complex 2 with HBF4 gave the cationic complex [Ni(C5Ph5)Ph2PCH2C(O)(C5H4)Fe(C5H5)}]BF46. Crystais of 6 belong to the orthorhombic space group Pbca with a= 19.427(6), b= 38.595(11), c= 13.001(4)Å and Z= 8. The structure was refined to R= 0.049 (R′= 0.067). The bonding of C5Ph5 contrasts

  [Ni（C 5 Ph 5）Br（CO）]与Ph 2 PCH 2 C（O）Ph在1,8-双（二​​甲基氨基）萘（质子海绵）存在下的反应得到螯合物[Ni（C 5 Ph 5）Ph 2 PCH C（O）Ph}] 1。配合物[Ni（C 5 Ph 5）Ph 2 PCH C（O）（C 5 H 4）Fe（C 5 H 5）}] 2，[Ni（C 5 Ph 5）Ph 2 PCH C（O ）（1,3-C 6 H 4）C（O）HCPPh 2 } Ni（C 5 Ph 5）] 3，[Ni（C 5 H 5）Ph 2 PCH C（O）Ph}] 4和[Ni（C 5 H 5）Ph 2 PCH C（O） （C 5 H 4）Fe（C 5 H 5）}] 5已使用适当的膦配体并采用与1相似的方法合成。配合物1，被NaBH 4激活在乙烯的低压低聚中表现出催化活性。在130°C和38 bar的乙烯压力下，对线性α-烯烃的选择性高达98％。用HBF