1,1',5,5'-bis[methylenedi(p-phenylene)]-di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) | 462628-73-5

• 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: 1,1',5,5'-bis[methylenedi(p-phenylene)]-di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane)
• 英文别名: 13,27,30,37-tetraphenyl-1,11,15,25-tetraza-13,27,30,37-tetraphosphaheptacyclo[23.3.3.311,15.22,5.27,10.216,19.221,24]dotetraconta-2(42),3,5(41),7,9,16(35),17,19(34),21(33),22,24(32),39-dodecaene
• CAS: 462628-73-5
• 化学式: C₅₈H₅₆N₄P₄
• 分子量: 933.004
• InChiKey: CGURRFLFRQOPSD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.72
• 重原子数：
  66.0
• 可旋转键数：
  4.0
• 环数：
  24.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  12.96
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  1,1',5,5'-bis[methylenedi(p-phenylene)]-di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) 在 sulfur 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 41.0h， 生成 bis{methylenedi[p-phenylene(N-methyl)aminomethyl]}di[P-(phenyl)phosphine sulfide]
  参考文献：
  名称：

  摘要：

  The reaction of bis(hydroxymethyl)phenylphosphine with 4,4'-diaminodiphenylmethane in DMF afforded 1,1',5,5'-bis[metylenedi(p-phenylene)]di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) (1) whose structure was established by X-ray diffraction analysis. Sulfurization and oxidation of macrocyclic tetraphosphine 1 gave rise to products 2 and 3, respectively, compound 3 being obtained as a stable hexahydrate. The reaction of bis(hydroxymethyl)phenylphosphine with bis(4-N-methylaminophenyl)methane in DMF followed by sulfurization yielded monocyclic bis{methylenedi[p-phenylene(N-methyl)amino-methyl]}di(P-phenyl)phosphine sulfide (4).

  DOI：

  10.1023/a:1015086419302
• 作为产物：
  描述：

  4,4'-二氨基二苯甲烷 、 双(羟甲基)苯膦 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.5h， 以51%的产率得到1,1',5,5'-bis[methylenedi(p-phenylene)]-di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane)
  参考文献：
  名称：

  摘要：

  The reaction of bis(hydroxymethyl)phenylphosphine with 4,4'-diaminodiphenylmethane in DMF afforded 1,1',5,5'-bis[metylenedi(p-phenylene)]di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) (1) whose structure was established by X-ray diffraction analysis. Sulfurization and oxidation of macrocyclic tetraphosphine 1 gave rise to products 2 and 3, respectively, compound 3 being obtained as a stable hexahydrate. The reaction of bis(hydroxymethyl)phenylphosphine with bis(4-N-methylaminophenyl)methane in DMF followed by sulfurization yielded monocyclic bis{methylenedi[p-phenylene(N-methyl)amino-methyl]}di(P-phenyl)phosphine sulfide (4).

  DOI：

  10.1023/a:1015086419302

文献信息

• Transformation of white phosphorus in the coordination sphere of nickel complexes with σ-donating ligands
  作者：Yu. H. Budnikova、A. G. Kafiyatullina、A. S. Balueva、R. M. Kuznetsov、V. I. Morozov、O. G. Sinyashin

  DOI：10.1023/b:rucb.0000012364.31262.ca

  日期：2003.11

  Oxidation of white phosphorus in the coordination sphere of the nickel(ii) complex with 1,1,1-tris(diphenylphosphinomethyl)ethane and 1,1",5,5"-bis[methylenedi(p-phenylene)]di(3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) was shown to be possible and accompanied by the transformation of P4 into the σ-P3 ligand. The change in the nickel state was monitored by cyclic voltammetry, 31P NMR spectroscopy

  白磷在镍 (ii) 配合物与 1,1,1-三（二苯基膦甲基）乙烷和 1,1",5,5"-双[亚甲基二(对亚苯基)]di(3) 的配位球中的氧化,7-二苯基-1,5-二氮杂-3,7-二磷酸环辛烷）被证明是可能的，并且伴随着 P4 向 σ-P3 配体的转化。通过循环伏安法、31P NMR光谱、ESR和IR光谱监测镍状态的变化。