dipropyl phenylboronate | 96080-52-3

• 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: dipropyl phenylboronate
• 英文别名: Phenylborsaeure-dipropylester；Phenyldipropyloxybor；phenyl-dipropoxy-borane；Phenyl-dipropoxy-boran；Phenyl(dipropoxy)borane
• CAS: 96080-52-3
• 化学式: C₁₂H₁₉BO₂
• 分子量: 206.093
• InChiKey: OGFKTELORHJGGJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.24
• 重原子数：
  15
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  dipropyl phenylboronate 生成 Methylphenylborinic acid
  参考文献：
  名称：

  Torssell, Acta Chemica Scandinavica (1947), 1955, vol. 9, p. 242,245

  摘要：

  DOI：
• 作为产物：
  描述：

  丙醇 、 苯硼酸 反应 0.25h， 生成 dipropyl phenylboronate
  参考文献：
  名称：

  Exploiting a basic chemosensitizing pharmacophore hypothesis. Part 1: Synthesis and biological evaluation of novel arylbromide and bicyclic chemosensitizers against drug-resistant malaria parasites

  摘要：

  An exploratory series of novel arylbromide and bicyclic chemosensitizers (modulators) against chloroquine-resistant Plasinodium falciparum were designed and synthesized on the basis of a basic chemosensitizing pharmacophore hypothesis in malaria. ortho-Substituted bromo and biphenyl ether compounds displayed the best activity from the series. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.04.033

文献信息

• Torssell, Acta Chemica Scandinavica (1947), 1954, vol. 8, p. 1779,1782,1784
  作者：Torssell

  DOI：——

  日期：——
• Torssell,K., Acta Chemica Scandinavica (1947), 1962, vol. 16, # 1, p. 87 - 93
  作者：Torssell,K.

  DOI：——

  日期：——
• Exploiting a basic chemosensitizing pharmacophore hypothesis. Part 1: Synthesis and biological evaluation of novel arylbromide and bicyclic chemosensitizers against drug-resistant malaria parasites
  作者：Franck Chouteau、David Ramanitrahasimbola、Philippe Rasoanaivo、Kelly Chibale

  DOI：10.1016/j.bmcl.2005.04.033

  日期：2005.6

  An exploratory series of novel arylbromide and bicyclic chemosensitizers (modulators) against chloroquine-resistant Plasinodium falciparum were designed and synthesized on the basis of a basic chemosensitizing pharmacophore hypothesis in malaria. ortho-Substituted bromo and biphenyl ether compounds displayed the best activity from the series. (c) 2005 Elsevier Ltd. All rights reserved.
• Torssell, Acta Chemica Scandinavica (1947), 1955, vol. 9, p. 242,245
  作者：Torssell

  DOI：——

  日期：——