| 139581-32-1

• CAS: 139581-32-1
• 化学式: C₄H₂₁B₁₀NS
• 分子量: 223.393
• InChiKey: YXNPEQQGZQRGET-UHFFFAOYSA-N

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

• 作为产物：
  描述：

  在 NaBH₄ 、 NaOH 作用下， 以 乙醇 为溶剂， 生成
  参考文献：
  名称：

  Substituted monocarbon carboranes involving thiol, disulfide or dimethyl sulfide ligands

  摘要：

  New sulfur-substituted derivatives of closo- and nido-monocarbon carboranes have been synthesised for their potential application in 10-B neutron capture therapy of tumours. The compounds 7-Me3N-4(6)-HS-nido-7-CB10H11 and 4,4'-, 6,6'- and 4,6'-S2(7-Me3N-nido-7-CB10H11)2 were obtained by Friedel-Crafts substitution of 7-Me3N-nido-7-CB10H12 with S2Cl2; high-temperature boron insertion and methylation of the products gave 1-Me2N-2-Me2S-closo-1-CB11H10 as a result of a cluster rearrangement process. Its structure has been confirmed by X-ray crystallography.

  DOI：

  10.1039/dt9920000119