2,4,6-tris(2,4,6-tri-t-butylphenoxy)-1,3,5,2,4,6-trioxatriphosphorinane | 96357-73-2

• 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: 2,4,6-tris(2,4,6-tri-t-butylphenoxy)-1,3,5,2,4,6-trioxatriphosphorinane
• 英文别名: 2,4,6-Tris(2,4,6-tritert-butylphenoxy)-1,3,5,2,4,6-trioxatriphosphinane
• CAS: 96357-73-2
• 化学式: C₅₄H₈₇O₆P₃
• 分子量: 925.202
• InChiKey: HSRGSDLAQXWEIR-UHFFFAOYSA-N

物化性质

• 沸点：
  702.8±70.0 °C(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  20.5
• 重原子数：
  63
• 可旋转键数：
  15
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  55.4
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2,4,6-tris(2,4,6-tri-t-butylphenoxy)-1,3,5,2,4,6-trioxatriphosphorinane 生成 2,4-bis(2,4,6-tri-t-butylphenoxy)-1,3,2,4-dioxadiphosphetane
  参考文献：
  名称：

  摘要：

  DOI：
• 作为产物：
  描述：

  2,4,6-三叔丁基苯酚 在 三正丁胺 、 水 、 丙酮 、 三氯化磷 作用下， 生成 2,4,6-tris(2,4,6-tri-t-butylphenoxy)-1,3,5,2,4,6-trioxatriphosphorinane
  参考文献：
  名称：

  2,4,6-Tris（2,6-二叔丁基-4-取代的苯氧基）-1,3,5,2,4,6-三氧三磷正烷。新型磷（III）-氧杂环族的合成，表征，x射线结构和固态磷31 NMR。

  摘要：

  DOI：

  10.1021/ja00279a047

文献信息

• Thermal Retro-Trimerization of Some 1,3,5,2,4,6-Trioxatriphosphorinanes to Phosphenites
  作者：Louis D. Quin、Alexey S. Ionkin

  DOI：10.1021/jo00121a042

  日期：1995.8

  Pyrolysis in a packed tube of the vapor from three 2,4,6-tris(aryloxy)-1,3,5,2,4,6-trioxatriphosphorinanes was performed at 300-350 degrees C and 10(-6) mm; the product was collected on a cold finger chilled by liquid nitrogen. The cracking of the trimer was complete, and the product at -195 degrees C appeared to consist only of the monomeric aryl phosphenite, ArOP=O. On warming, dimerization occurred, later followed by trimer formation. The weak P-31 MMR signal for the phosphenite (about delta 238 for three O-aryl derivatives) persisted in the solution for several weeks if water was rigorously excluded. Treatment of the phosphenite with water or alcohols at -195 degrees C gave a mixture of products; the major product (ArO-PH(O)OH) came from addition of the nucleophile to the P=O bond, but significant amounts (10-20%) of dialkyl H-phosphonates (HP(O)(OR)(2)) were present, apparently from displacement of the O-aryl substituent of the phosphenite, followed by addition to the double bond.
• ——
  作者：CHASAR D. W.

  DOI：——

  日期：——
• 2,4,6-Tris(substituted phenoxy)-1,3,5,2,4,6-trioxatriphosphorinanes
  申请人：The B.F. GOODRICH Company

  公开号：EP0128368B1

  公开（公告）日：1987-08-12
• US4507416A
  申请人：——

  公开号：US4507416A

  公开（公告）日：1985-03-26
• US4515733A
  申请人：——

  公开号：US4515733A

  公开（公告）日：1985-05-07