2-FC6H4OP(O)(NHBn)2 | 1240379-68-3

• 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: 2-FC6H4OP(O)(NHBn)2
• 英文别名: N-[(benzylamino)-(2-fluorophenoxy)-oxidophosphaniumyl]-1-phenylmethanamine
• CAS: 1240379-68-3
• 化学式: C₂₀H₂₀FN₂O₂P
• 分子量: 370.363
• InChiKey: ITODHBHEHCNBHX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  26
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  56.4
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-FC6H4OP(O)(NHBn)2 在 水 、 zinc(II) chloride 作用下， 以 四氢呋喃 为溶剂， 反应 24.0h， 以70%的产率得到[2-FC6H4OP(O)O(OH)][BnNH3]
  参考文献：
  名称：

  New phosphoroamidate compounds: Synthesis, structural characterization and studies on ZnCl2 assisted hydrolysis of the P–N bond

  摘要：

  A variety of phosphorodiamidate compounds were synthesized from the corresponding phosphorodichloridate intermediates and phosphorus oxychloride. These were completely characterized using different spectroscopic methods and single crystal X-ray diffraction studies on one of them. Studies revealed that water in the presence of a mild Lewis acid like ZnCl2 was found to assist the hydrolysis of the P-N linkage. The proof of this concept was effectively realized through the hydrolysis of hexamethylphosphoramide. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.04.002
• 作为产物：
  描述：

  2-氟苯酚 在 lithium chloride 、 三氯氧磷 作用下， 以 甲苯 为溶剂， 反应 60.0h， 生成 2-FC6H4OP(O)(NHBn)2
  参考文献：
  名称：

  New phosphoroamidate compounds: Synthesis, structural characterization and studies on ZnCl2 assisted hydrolysis of the P–N bond

  摘要：

  A variety of phosphorodiamidate compounds were synthesized from the corresponding phosphorodichloridate intermediates and phosphorus oxychloride. These were completely characterized using different spectroscopic methods and single crystal X-ray diffraction studies on one of them. Studies revealed that water in the presence of a mild Lewis acid like ZnCl2 was found to assist the hydrolysis of the P-N linkage. The proof of this concept was effectively realized through the hydrolysis of hexamethylphosphoramide. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2010.04.002

文献信息

• New phosphoroamidate compounds: Synthesis, structural characterization and studies on ZnCl2 assisted hydrolysis of the P–N bond
  作者：Payal Malik、Debashis Chakraborty、Venkatachalam Ramkumar

  DOI：10.1016/j.poly.2010.04.002

  日期：2010.7

  A variety of phosphorodiamidate compounds were synthesized from the corresponding phosphorodichloridate intermediates and phosphorus oxychloride. These were completely characterized using different spectroscopic methods and single crystal X-ray diffraction studies on one of them. Studies revealed that water in the presence of a mild Lewis acid like ZnCl2 was found to assist the hydrolysis of the P-N linkage. The proof of this concept was effectively realized through the hydrolysis of hexamethylphosphoramide. (C) 2010 Elsevier Ltd. All rights reserved.