ethyl 1-hydroxyphenanthrene-3-carboxylate | 1187567-10-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: ethyl 1-hydroxyphenanthrene-3-carboxylate
• 英文别名: Ethyl 1-hydroxyphenanthrene-3-carboxylate
• CAS: 1187567-10-7
• 化学式: C₁₇H₁₄O₃
• 分子量: 266.296
• InChiKey: KRRKMWWKCBWUGG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  ethyl 1-hydroxyphenanthrene-3-carboxylate 、 溴甲苯 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 10.08h， 以95%的产率得到ethyl 1-benzyloxyphenanthrene-3-carboxylate
  参考文献：
  名称：

  Synthesis and preliminary evaluation of duocarmycin analogues incorporating the 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indol-4-one (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indol-4-one (iso-CNI) alkylation subunits

  摘要：

  Efficient syntheses and a preliminary evaluation of 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indole (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indole (iso-CNI), and their derivatives containing an anthracene and phenanthrene variant of the CC-1065 or duocarmycin alkylation Subunit are detailed. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.02.065
• 作为产物：
  描述：

  在 potassium carbonate 、 氯化铵 作用下， 以 乙醇 、 水 、 乙酸乙酯 为溶剂， 反应 4.0h， 以149 mg的产率得到ethyl 1-hydroxyphenanthrene-3-carboxylate
  参考文献：
  名称：

  Synthesis and preliminary evaluation of duocarmycin analogues incorporating the 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indol-4-one (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indol-4-one (iso-CNI) alkylation subunits

  摘要：

  Efficient syntheses and a preliminary evaluation of 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indole (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indole (iso-CNI), and their derivatives containing an anthracene and phenanthrene variant of the CC-1065 or duocarmycin alkylation Subunit are detailed. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.02.065

文献信息

• Synthesis and preliminary evaluation of duocarmycin analogues incorporating the 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indol-4-one (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indol-4-one (iso-CNI) alkylation subunits
  作者：Carla M. Gauss、Akiyuki Hamasaki、Jay P. Parrish、Karen S. MacMillan、Thomas J. Rayl、Inkyu Hwang、Dale L. Boger

  DOI：10.1016/j.tet.2009.02.065

  日期：2009.8

  Efficient syntheses and a preliminary evaluation of 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[2,3-e]indole (CNI) and 1,2,11,11a-tetrahydrocyclopropa[c]naphtho[1,2-e]indole (iso-CNI), and their derivatives containing an anthracene and phenanthrene variant of the CC-1065 or duocarmycin alkylation Subunit are detailed. (C) 2009 Elsevier Ltd. All rights reserved.