tert-butyl-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yloxy)-dimethylsilane | 150646-50-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: tert-butyl-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yloxy)-dimethylsilane
• CAS: 150646-50-7
• 化学式: C₂₆H₂₇O₃PSi
• 分子量: 446.558
• InChiKey: DUVQLZVWZWAGQH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.03
• 重原子数：
  31.0
• 可旋转键数：
  2.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  35.51
• 氢给体数：
  0.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  苯甲醛 、 tert-butyl-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yloxy)-dimethylsilane 以 甲苯 为溶剂， 反应 72.0h， 以16%的产率得到tert-butyl-dimethyl-[(13-oxo-12,14-dioxa-13λ5-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)-phenylmethoxy]silane
  参考文献：
  名称：

  Asymmetric Silylphosphite Esters: Synthesis and Reactivity of (rac-O,O-Binaphtholato)POSiR₃(R₃= Ph₃,^tBuMe₂, Et₃)

  摘要：

  The new, silylphosphite compounds, (rac-O,O-binaphtholato)POSiR3 (R3 = Ph3, tBuMe2, Et3) have been synthesised by the reactions of (rac-O,O-binaphtholato)PCl and R3SiOH. The abilities of these silylphosphite esters to act as phosphonylating agents towards benzaldehyde have been investigated.

  DOI：

  10.1080/00397919308011262
• 作为产物：
  描述：

  S-1,1'-联-2-萘酚 在 三乙胺 、 三氯化磷 作用下， 以 甲苯 为溶剂， 反应 16.0h， 生成 tert-butyl-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yloxy)-dimethylsilane
  参考文献：
  名称：

  Asymmetric Silylphosphite Esters: Synthesis and Reactivity of (rac-O,O-Binaphtholato)POSiR₃(R₃= Ph₃,^tBuMe₂, Et₃)

  摘要：

  The new, silylphosphite compounds, (rac-O,O-binaphtholato)POSiR3 (R3 = Ph3, tBuMe2, Et3) have been synthesised by the reactions of (rac-O,O-binaphtholato)PCl and R3SiOH. The abilities of these silylphosphite esters to act as phosphonylating agents towards benzaldehyde have been investigated.

  DOI：

  10.1080/00397919308011262