9-(hydroxybut-1-ynyl)-10-methoxyanthracene | 149849-63-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 9-(hydroxybut-1-ynyl)-10-methoxyanthracene
• CAS: 149849-63-8
• 化学式: C₁₉H₁₆O₂
• 分子量: 276.335
• InChiKey: OEMSFLLVAUOZPI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.74
• 重原子数：
  21.0
• 可旋转键数：
  2.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  29.46
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  9-(hydroxybut-1-ynyl)-10-methoxyanthracene 在 正丁基锂 、 potassium tert-butylate 作用下， 反应 25.5h， 生成
  参考文献：
  名称：

  Artificial allosteric receptors for nucleotide bases and alkali-metal cations

  摘要：

  New allosteric thymine receptors, 2,6-diamidopyridine derivatives tethered to an anthracene ring by a polyoxyethylene chain, were synthesized. In these receptors, binding of 1-butylthymine was enhanced by a factor of 4-6 by recognition of sodium cations, and the changes in the electron density of the anthracene ring were found to have influence on the allosterism by through-space interaction. The anthracene-linked diamidopyridines represent a rationally designed new class of artificial allosteric receptors.

  DOI：

  10.1021/ja00071a021
• 作为产物：
  描述：

  9-bromo-10-methoxyanthracene 、 3-丁炔-1-醇 在 bis-triphenylphosphine-palladium(II) chloride 、 copper(l) iodide 、 二正丁胺 作用下， 反应 15.0h， 以91%的产率得到9-(hydroxybut-1-ynyl)-10-methoxyanthracene
  参考文献：
  名称：

  Artificial allosteric receptors for nucleotide bases and alkali-metal cations

  摘要：

  New allosteric thymine receptors, 2,6-diamidopyridine derivatives tethered to an anthracene ring by a polyoxyethylene chain, were synthesized. In these receptors, binding of 1-butylthymine was enhanced by a factor of 4-6 by recognition of sodium cations, and the changes in the electron density of the anthracene ring were found to have influence on the allosterism by through-space interaction. The anthracene-linked diamidopyridines represent a rationally designed new class of artificial allosteric receptors.

  DOI：

  10.1021/ja00071a021

文献信息

• Artificial allosteric receptors for nucleotide bases and alkali-metal cations
  作者：Masahiko Inouye、Takashi Konishi、Kakuzo Isagawa

  DOI：10.1021/ja00071a021

  日期：1993.9

  New allosteric thymine receptors, 2,6-diamidopyridine derivatives tethered to an anthracene ring by a polyoxyethylene chain, were synthesized. In these receptors, binding of 1-butylthymine was enhanced by a factor of 4-6 by recognition of sodium cations, and the changes in the electron density of the anthracene ring were found to have influence on the allosterism by through-space interaction. The anthracene-linked diamidopyridines represent a rationally designed new class of artificial allosteric receptors.