4-Tert-butyl-2-[[11,17,23-tritert-butyl-4-[(5-tert-butyl-2-hydroxyphenyl)methylideneamino]-25,26,27,28-tetrapropoxy-5-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]iminomethyl]phenol | 1190216-09-1

• 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: 4-Tert-butyl-2-[[11,17,23-tritert-butyl-4-[(5-tert-butyl-2-hydroxyphenyl)methylideneamino]-25,26,27,28-tetrapropoxy-5-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]iminomethyl]phenol
• CAS: 1190216-09-1
• 化学式: C₇₄H₉₈N₂O₆
• 分子量: 1111.6
• InChiKey: UOCAVLURPQVXFC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  21.4
• 重原子数：
  82
• 可旋转键数：
  21
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  102
• 氢给体数：
  2
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  5-叔丁基-2-羟基苯甲醛 、 11,17,23-Tritert-butyl-25,26,27,28-tetrapropoxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15(26),16,18,21(25),22-dodecaene-4,5-diamine 以 乙醇 、 二氯甲烷 为溶剂， 反应 12.0h， 以492 mg的产率得到4-Tert-butyl-2-[[11,17,23-tritert-butyl-4-[(5-tert-butyl-2-hydroxyphenyl)methylideneamino]-25,26,27,28-tetrapropoxy-5-pentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(24),3(28),4,6,9,11,13(27),15(26),16,18,21(25),22-dodecaenyl]iminomethyl]phenol
  参考文献：
  名称：

  Synthesis and structures of novel enantiopure inherently chiral calix[4]arene-derived salphen ligands and their transition-metal complexes

  摘要：

  Synthesis and structures of two pairs of novel enantiopure inherently chiral calix[4]arene-derived salphen ligands were described. Several Zn2+, Ni2+, and Cu2+ complexes of the chiral ligands were also prepared, and their structures were characterized by NMR, IR, CID, and HRMS spectra. (C) 2009 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2009.07.064