chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN22,κN23,κN24]-boron(III) | 1132806-09-7

• 英文名称: chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN22,κN23,κN24]-boron(III)
• 英文别名: chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN²²,κN²³,κN²⁴]-boron(III)
• CAS: 1132806-09-7
• 化学式: C₃₁H₁₈BClN₆S
• 分子量: 552.854
• InChiKey: XGLLQAQIEHXWSZ-UHFFFAOYSA-N

物化性质

• 熔点：
  >250 °C(Solvent: Dichloromethane; Methanol)

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为反应物：
  描述：

  chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN22,κN23,κN24]-boron(III) 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 以76%的产率得到chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN²²,κN²³,κN²⁴]-boron(III)
  参考文献：
  名称：

  A diastereoselective process induced in a curved aromatic molecule: oxidation of thioether-substituted subphthalocyanines

  摘要：

  Different sulfoxide-substituted subphthalocyanines have been synthesized by oxidation reaction of the corresponding thioether precursors. We have observed for the first time that when the oxidation takes place close to the macrocyclic core, the intrinsically chiral subphthalocyanine can induce a high degree of diastereoselectivity in this process. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.11.126
• 作为产物：
  描述：

  3-(p-tolylthio)phthalonitrile 、 1,2-二氰基苯 在 三氯化硼 作用下， 以 对二甲苯 为溶剂， 反应 0.5h， 以7%的产率得到chloro-[1-(p-tolylthio)-7,12:14,19-diimino-21,5-nitrilo-5H-tribenzo[c,h,m][1,6,11]-triazacyclopentadecinato-(2)-κN22,κN23,κN24]-boron(III)
  参考文献：
  名称：

  A diastereoselective process induced in a curved aromatic molecule: oxidation of thioether-substituted subphthalocyanines

  摘要：

  Different sulfoxide-substituted subphthalocyanines have been synthesized by oxidation reaction of the corresponding thioether precursors. We have observed for the first time that when the oxidation takes place close to the macrocyclic core, the intrinsically chiral subphthalocyanine can induce a high degree of diastereoselectivity in this process. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.11.126