sodium O,O'-(dibenzyl)phosphorodithioate | 848421-80-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 有机二硫代磷酸及其衍生物
• 英文名称: sodium O,O'-(dibenzyl)phosphorodithioate
• 英文别名: sodium O,O'-dibenzyldithiophosphate
• CAS: 848421-80-7
• 化学式: C₁₄H₁₄O₂PS₂*Na
• 分子量: 332.359
• InChiKey: ALMDSLGQKPDWJI-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  20.0
• 可旋转键数：
  6.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  18.46
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  sodium O,O'-(dibenzyl)phosphorodithioate 以 乙醇 、 水 为溶剂， 生成 bis(O,O'-dibenzyldithiophosphato)(2,2'-bipyridine)nickel(II) dihydrate
  参考文献：
  名称：

  Synthesis, Crystal Structure and Thermal Studies ofbis(O,O′‐Dibenzyldithiophosphato)‐(2,2′‐Bipyridine)nickel(II) Complex

  摘要：

  The bis(O,O'-dibenzyldithiophosphato)Ni(II) adduct, [(PhCH2O)(2)PS2](2) Ni(bpy), was synthesized by the reaction of [(PhCH2O)(2)PS2](2)Ni. with 2,2'-bipyridine in the solid state. Single crystals of the title compound as the dihydrate were obtained by recrystallization in ethanol-distilled water (v/v = 9: 1). The structure characterization was performed by means of IR; elemental analyses, and single crystal x-ray analysis. The crystal of the title compound consists of two disconnected structural units, each of which includes two non-coordination water molecules. The coordination geometry of each Ni atom is a distorted octahedron. The thermogravimetric (TG) data indicate that thermal decomposition of the title compound takes place in four steps and the residue is Ni(OPS2)(2).

  DOI：

  10.1081/sim-200026301

文献信息

• New Organic Derivatives of <i>O,O</i>′-(<i>o-, m-, and</i> <i>p</i>-Ditolyl)/Dibenzyldithiophosphates: Synthesis and Characterization
  作者：Sangeeta Sharma、Suresh Magotra、Sushil K. Pandey

  DOI：10.1080/10426500802445340

  日期：2009.8.6

  Reactions of (m- and p-ClC 6 H 4 NH 2 ), (p-BrC 6 H 4 NO 2 ), and (p-ClCOC 6 H 4 NO 2 ) with sodium O,O′-ditolyl/dibenzylphosphorodithionates, (ArO) 2 PS 2 Na, (Ar = o−, m−, and p−CH 3 C 6 H 4 or –C 6 H 5 CH 2 ) in 1:1 molar ratio in refluxing toluene under anhydrous conditions resulted in the formation of the compounds (ArO) 2 PS 2 C 6 H 4 L and (ArO) 2 PS 2 COC 6 H 4 L (L = NH 2 or NO 2 ) in 87–94%

  (m-和 p-ClC 6 H 4 NH 2 )、(p-BrC 6 H 4 NO 2 ) 和 (p-ClCOC 6 H 4 NO 2 ) 与 O,O'-二甲苯基/二苄基连二硫代磷酸钠的反应，（ ArO) 2 PS 2 Na，（Ar = o-、m- 和 p-CH 3 C 6 H 4 或 –C 6 H 5 CH 2 ）在无水条件下回流甲苯中以 1:1 的摩尔比形成化合物 (ArO) 2 PS 2 C 6 H 4 L 和 (ArO) 2 PS 2 COC 6 H 4 L（L = NH 2 或 NO 2 ），产率为 87-94%。这些粘性化合物通过元素分析、分子量测定以及 IR 和 NMR（ 1 H、 13 C 和 31 P）光谱研究进行表征，其揭示了二硫代磷酸酯部分与苯环的碳的单齿键合模式。导致 P-S-C 键的有机部分。
• Syntheses, characterization, and biocidal aspects of O,O′-ditolyl/dibenzyldithiophosphates of lanthanum(III) and their adducts with nitrogen and phosphorus donor bases
  作者：A. Syed、Sushil K. Pandey

  DOI：10.1007/s00706-013-0952-4

  日期：2013.8

  O,O'-Ditolyldithiophosphates of lanthanum(III) corresponding to [[(o-, m-, p-CH3C6H4O/C6H5CH2O)(2)PS2](3)La] have been synthesized by the reaction of lanthanum chloride, LaCl3, with sodium salt of O,O'-ditolyldithiophosphates (o-, m-, p-CH3C6H4O/C6H5CH2O)(2)PS2Na, in 1:3 molar ratio under anhydrous conditions. The mixed ligand dithiophosphato complexes of the composition [[(o-, m-, p-CH3C6H4O)(2)PS2](2)[(OCH2)C(CH3)(2)(CH2O)PS2]La] have also been isolated by the reaction of lanthanum chloride, sodium ditolylphosphorodithioates, (o-, m-, p-CH3C6H4O)(2)PS2Na, and sodium neopentylenephosphorodithioate, (OCH2)C(CH3)(2)(CH2O)PS2Na, in 1:2:1 molar ratio under anhydrous conditions. These complexes have formed adducts with nitrogen and phosphorus donor molecules by straightforward reaction of these complexes with donor ligands, which have the composition of the type [[(o-, m-, p-CH3C6H4O/C6H5CH2O)(2)PS2](3)La center dot nL] (L = C10H8N2, C12H8N2 for n = 1 and P(C6H5)(3), C5H5N for n = 2) and [[(o-, m-, p-CH3C6H4O)(2)PS2](2)[(OCH2)C(CH3)(2)(CH2O)PS2]La center dot 2P(C6H5)(3)]. All the complexes have been characterized by elemental analysis, mass, IR, and heteronuclear NMR (H-1, C-13, and P-31) spectroscopic studies. Coordination numbers of six and eight are suggested around the lanthanum atom in these complexes, leading to octahedral and dodecahedral geometries. These complexes were also tested in vitro to evaluate their activity against the fungus Fusarium oxysporum and bacteria Pseudomonas alkaligens and Bacillus subtilis..