4-bromo-1,7-dimethoxynaphthalene | 2059-68-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 4-bromo-1,7-dimethoxynaphthalene
• 英文别名: 4-Brom-1,7-dimethoxy-naphthalin；1-Bromo-4,6-dimethoxynaphthalene；1-bromo-4,6-dimethoxynaphthalene
• CAS: 2059-68-9
• 化学式: C₁₂H₁₁BrO₂
• 分子量: 267.122
• InChiKey: QYTAVUPAUOYWOJ-UHFFFAOYSA-N

物化性质

• 熔点：
  71 °C
• 沸点：
  364.4±22.0 °C(Predicted)
• 密度：
  1.422±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2909309090

反应信息

• 作为反应物：
  描述：

  4-bromo-1,7-dimethoxynaphthalene 在 正丁基锂 、 硝酸 作用下， 以 苯 为溶剂， 生成 1,7-dimethoxy-8-nitronaphthalene
  参考文献：
  名称：

  Synthesis and biological activity of some known and putative duloxetine metabolites

  摘要：

  Several putative phase I duloxetine metabolites, 4-hydroxy-, 5-hydroxy-, 6-hydroxy-, 5-hydroxy-6-methoxy-, 6-hydroxy5-methoxy-, 5,6-dihydroxy-, and 4,6-dihydroxyduloxetine were synthesized, and their phase II metabolite as glucuronide or sulfate conjugates were also synthesized. Their in vitro binding activities were compared to that of parent compound duloxetine. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.04.066
• 作为产物：
  描述：

  1,7-二羟基萘 在 氢氧化钾 、 N-溴代丁二酰亚胺(NBS) 作用下， 生成 4-bromo-1,7-dimethoxynaphthalene
  参考文献：
  名称：

  Synthesis and biological activity of some known and putative duloxetine metabolites

  摘要：

  Several putative phase I duloxetine metabolites, 4-hydroxy-, 5-hydroxy-, 6-hydroxy-, 5-hydroxy-6-methoxy-, 6-hydroxy5-methoxy-, 5,6-dihydroxy-, and 4,6-dihydroxyduloxetine were synthesized, and their phase II metabolite as glucuronide or sulfate conjugates were also synthesized. Their in vitro binding activities were compared to that of parent compound duloxetine. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2004.04.066

文献信息

• 안트라센 유도체 및 이를 포함하는 유기 발광 소자
  申请人：SFC CO., LTD. 에스에프씨 주식회사(120060087061) Corp. No ▼ 135511-0105889BRN ▼134-81-54429

  公开号：KR20150043020A

  公开（公告）日：2015-04-22

  본 발명은 안트라센 유도체 및 이를 포함하는 유기 발광 소자에 관한 것으로서, 보다 상세하게는, 하기 화학식 A로 표시되는 유기발광소자용 화합물 및 이를 포함하는 유기 발광 소자에 관한 것이다. [화학식 A] 상기 [화학식 A] 에서, R, R, m, n, X 내지 X은 발명의 상세한 설명에 기재된 바와 같다.

  本发明涉及蒽衍生物及含有其的有机发光器件，更详细地说，涉及用化学式A表示的有机发光器件用化合物及含有其的有机发光器件。在上述化学式A中，R、R、m、n、X到X如本发明的详细描述中所述。
• Synthesis and biological activity of some known and putative duloxetine metabolites
  作者：F. Kuo、T.A. Gillespie、P. Kulanthaivel、R.J. Lantz、T.W. Ma、D.L. Nelson、P.G. Threlkeld、W.J. Wheeler、P. Yi、M. Zmijewski

  DOI：10.1016/j.bmcl.2004.04.066

  日期：2004.7

  Several putative phase I duloxetine metabolites, 4-hydroxy-, 5-hydroxy-, 6-hydroxy-, 5-hydroxy-6-methoxy-, 6-hydroxy5-methoxy-, 5,6-dihydroxy-, and 4,6-dihydroxyduloxetine were synthesized, and their phase II metabolite as glucuronide or sulfate conjugates were also synthesized. Their in vitro binding activities were compared to that of parent compound duloxetine. (C) 2004 Elsevier Ltd. All rights reserved.