Trimethyl-[1-[(3-methylphenyl)methyl]-5-phenyltriazol-4-yl]silane | 1190693-08-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: Trimethyl-[1-[(3-methylphenyl)methyl]-5-phenyltriazol-4-yl]silane
• 英文别名: trimethyl-[1-[(3-methylphenyl)methyl]-5-phenyltriazol-4-yl]silane
• CAS: 1190693-08-3
• 化学式: C₁₉H₂₃N₃Si
• 分子量: 321.497
• InChiKey: MIKDAFYMNHJYPF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.85
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  30.7
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  碘苯 、 3-甲基苄基叠氮 、 三甲基(4,4,5,5-四甲基)-1,3,2-二氧硼烷-2-基)乙炔硅烷 在 potassium phosphate 、 Pd₂(dba)3 、 tri tert-butylphosphoniumtetrafluoroborate 作用下， 以 邻二氯苯 、 乙腈 为溶剂， 反应 40.0h， 生成 Trimethyl-[1-[(3-methylphenyl)methyl]-5-phenyltriazol-4-yl]silane
  参考文献：
  名称：

  A direct route to triazole boronic esters and their application in the synthesis of small molecule arrays

  摘要：

  Alkynylboronates represent useful substrates for the direct synthesis of triazole boronic esters by their thermal cycloaddition with azides. A telescoped cycloaddition-cross-coupling protocol is reported and its employment in the synthesis of a small triazole array is disclosed. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.07.085

文献信息

• A direct route to triazole boronic esters and their application in the synthesis of small molecule arrays
  作者：Jianhui Huang、Simon J.F. Macdonald、Anthony W.J. Cooper、Gail Fisher、Joseph P.A. Harrity

  DOI：10.1016/j.tetlet.2009.07.085

  日期：2009.9

  Alkynylboronates represent useful substrates for the direct synthesis of triazole boronic esters by their thermal cycloaddition with azides. A telescoped cycloaddition-cross-coupling protocol is reported and its employment in the synthesis of a small triazole array is disclosed. (C) 2009 Elsevier Ltd. All rights reserved.