4-(3-nitrophenoxy)phenol | 82720-94-3

• 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: 4-(3-nitrophenoxy)phenol
• 英文别名: p-(m-nitrophenoxy)phenol
• CAS: 82720-94-3
• 化学式: C₁₂H₉NO₄
• 分子量: 231.208
• InChiKey: NZHLVKVLXNJORY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  75.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-(3-nitrophenoxy)phenol 生成 1-benzoyloxy-4-(3-nitro-phenoxy)-benzene
  参考文献：
  名称：

  Ikawa, Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan, 1959, vol. 79, p. 1498,1501

  摘要：

  DOI：
• 作为产物：
  描述：

  1-(4-甲氧基苯氧基)-3-硝基苯 在 三溴化硼 作用下， 以 二氯甲烷 为溶剂， 反应 3.0h， 生成 4-(3-nitrophenoxy)phenol
  参考文献：
  名称：

  Discovery of Dual Target Inhibitors against Cyclooxygenases and Leukotriene A₄ Hydrolyase

  摘要：

  Dual target inhibitors against COX-2. and LTA(4)H were designed by adding functional groups from a marketed COX-2 inhibitor, Nimesulide, to an existing LTA(4)H inhibitor 1-(2-(4-phenoxyphenoxy) ethyl) pyrrolidine. A series of phenoxyphenyl pyrrolidine compounds were synthesized and tested for their inhibition activities using enzyme assays and human whole blood assay. Introduction of small electron withdrawing groups like NO2 and CF3 in the ortho-position of the terminal phenyl ring was found to change the original single target LTA(4)H inhibitor to dual target LTA(4)H and COX-2 inhibitors. Compound 5a and 5m showed dual LTA(4)H and COX-2 inhibition activities in the enzyme assays and the I-EWE assay with IC50 values in the micromolar to submicromolar range. As their activities in HWB assay were comparable to the two starting single target inhibitors, the two compounds are promising for further studies. The strategy used in the current study may be generally applicable to other dual target drug designs.

  DOI：

  10.1021/jm200063s

文献信息

• Cyclodienones. X. Reaction of Halo-cyclohexadien-1-ones with Phenols in the Presence of α-Picoline and Preparation of 4-Hydroxy- and 2-Hydroxyphenyl Aryl Ethers
  作者：Masashi Tashiro、Takashi Itoh、Gouki Fukata

  DOI：10.1246/bcsj.57.416

  日期：1984.2

  Reaction of 4-halocyclohexadienones such as 4-bromo-(1a), 4-chloro-2,4,6-tri-t-butyl-(1b), 2,4-dichloro-4,6-di-t-butyl-2,5-cyclohexadien-1-one, and 2,4-dichloro-2,6-di-t-butyl-3,5-cyclohexadien-1-one with phenols in the presence of α-picoline was carried out under various conditions. The reaction of 1a and 1b with phenols afforded the corresponding 2-aryloxy-4,6-di-t-butyl phenols together with various

  4-卤代环己二烯酮如4-溴-(1a)、4-氯-2,4,6-三叔丁基-(1b)、2,4-二氯-4,6-二叔丁基的反应-2,5-环己二烯-1-酮和2,4-二氯-2,6-二叔丁基-3,5-环己二烯-1-酮在α-甲基吡啶存在下与苯酚进行各种条件。1a 和 1b 与苯酚反应得到相应的 2-芳氧基-4,6-二叔丁基苯酚以及各种副产物。由上述反应得到的 2-芳氧基-4,6-二-叔丁基-苯酚在 AlCl3 催化下发生叔丁基转移反应，得到相应的 2-羟基苯基芳基醚。4-芳氧基-2,4,6-三叔丁基-2,5-环己二烯-1-酮的类似反应也得到相应的4-羟基苯基芳基醚。
• Carbamic acid esters and use as pesticides
  申请人：Hoffmann-La Roche Inc.

  公开号：US04413010A1

  公开（公告）日：1983-11-01

  Carbamic acid compounds of the formula ##STR1## wherein R.sup.1, R.sup.2, R.sup.3, R.sup.4, R.sup.5, R.sup.6, X and Y are as hereinafter set forth, processes for their preparation, pesticidal compositions containing one or more of the carbamic acid compounds as the active ingredient and methods for using the pesticidal compositions for the control of pests, particularly insects, mites and nematodes, are described.

  本文描述了化学式为##STR1##的碳酰胺化合物，其中R.sup.1，R.sup.2，R.sup.3，R.sup.4，R.sup.5，R.sup.6，X和Y的含义如下，以及其制备过程，包含一种或多种碳酰胺化合物作为活性成分的杀虫剂组合物，以及使用该杀虫剂组合物控制害虫，特别是昆虫、螨和线虫的方法。
• Carbamic acid compound and use as a pesticide
  申请人：Hoffmann-La Roche Inc.

  公开号：US04607051A1

  公开（公告）日：1986-08-19

  Carbamic acid compounds of the formula ##STR1## wherein R.sup.1, R.sup.2, R.sup.3, R.sup.4, R.sup.5, R.sup.6, X and Y are as hereinafter set forth, processes for their preparation, pesticidal compositions containing one or more of the carbamic acid compounds as the active ingredient and methods for using the pesticidal compositions for the control of pests, particularly insects, mites and nematodes, are described.

  本文描述了化学式为##STR1##的碳酸化合物，其中R.sup.1，R.sup.2，R.sup.3，R.sup.4，R.sup.5，R.sup.6，X和Y的定义如下，以及它们的制备过程，含有一种或多种碳酸化合物作为活性成分的杀虫剂组合物，以及使用这些杀虫剂组合物控制害虫，特别是昆虫、螨和线虫的方法。
• Solvent-switchable regioselective 1,2- or 1,6-addition of quinones with boronic acids
  作者：Qi Xia、Yaxuan Zhou、Xiaoning Yang、Yanqiu Zhang、Jiayi Wang、Gonghua Song

  DOI：10.1039/d3cc01968c

  日期：——

  An efficient copper-catalyzed solvent-switchable regioselective 1,2- or 1,6-addition of quinones with boronic acids has been developed. This novel catalytic protocol for the synthesis of various quinols and 4-phenoxyphenols was enabled by a simple solvent swap between H2O and MeOH. It features mild reaction conditions, simple and easy operation, broad substrate scope and excellent regioselectivity

  已经开发出一种有效的铜催化溶剂可转换的醌与硼酸的区域选择性 1,2-或 1,6-加成反应。这种用于合成各种对苯二酚和 4-苯氧基苯酚的新颖催化方案是通过 H 2 O 和 MeOH 之间的简单溶剂交换实现的。其具有反应条件温和、操作简单易行、底物范围广、区域选择性优良等特点。还成功地研究了克级反应以及两种加成产物的进一步转化。
• TASHIRO, MASASHI;ITOH, TAKASHI;FUKATA, GOUKI, BULL. CHEM. SOC. JAP., 1984, 57, N 2, 416-420
  作者：TASHIRO, MASASHI、ITOH, TAKASHI、FUKATA, GOUKI

  DOI：——

  日期：——