1,2-Dimethoxy-4-(3-phenylsulfanylpropyl)benzene | 1175706-69-0

• 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: 1,2-Dimethoxy-4-(3-phenylsulfanylpropyl)benzene
• 英文别名: 1,2-dimethoxy-4-(3-phenylsulfanylpropyl)benzene
• CAS: 1175706-69-0
• 化学式: C₁₇H₂₀O₂S
• 分子量: 288.411
• InChiKey: LLJCHXNMBLHSEP-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：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  43.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1,2-Dimethoxy-4-(3-phenylsulfanylpropyl)benzene 在 4,4'-二叔丁基苯并 、 lithium 、 水 、 氯化铵 作用下， 以 四氢呋喃 为溶剂， 反应 0.5h， 以95%的产率得到1,2-二甲氧基-4-N-丙烯基苯
  参考文献：
  名称：

  The effect of ortho-substitution on the efficacy of biphenyls in mediating electron transfer from lithium

  摘要：

  A systematic study into the effect of increasing ortho-substitution of a range of biphenyls with respect to their ability to mediate electron transfer from lithium metal is described. A synthetic investigation has demonstrated the requirements for effective mediation. The electrochemical reduction of the mediators and of the two substrates was studied in THE 0.1 M TBAP, at platinum microelectrodes both at room temperature and at low temperature. The formal potentials, E(t)(0) extracted from the cyclic voltammograms, are in agreement with results of the synthetic Study and computational calculations also provide a correlation. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.04.057
• 作为产物：
  描述：

  3-(3,4-dimethoxyphenyl)propyl methanesulfonate 、 苯硫酚 在 sodium methylate 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 16.5h， 以92%的产率得到1,2-Dimethoxy-4-(3-phenylsulfanylpropyl)benzene
  参考文献：
  名称：

  The effect of ortho-substitution on the efficacy of biphenyls in mediating electron transfer from lithium

  摘要：

  A systematic study into the effect of increasing ortho-substitution of a range of biphenyls with respect to their ability to mediate electron transfer from lithium metal is described. A synthetic investigation has demonstrated the requirements for effective mediation. The electrochemical reduction of the mediators and of the two substrates was studied in THE 0.1 M TBAP, at platinum microelectrodes both at room temperature and at low temperature. The formal potentials, E(t)(0) extracted from the cyclic voltammograms, are in agreement with results of the synthetic Study and computational calculations also provide a correlation. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.04.057

文献信息

• The effect of ortho-substitution on the efficacy of biphenyls in mediating electron transfer from lithium
  作者：Timothy J. Donohoe、Neil M. Kershaw、Ronan Baron、Richard G. Compton

  DOI：10.1016/j.tet.2009.04.057

  日期：2009.7

  A systematic study into the effect of increasing ortho-substitution of a range of biphenyls with respect to their ability to mediate electron transfer from lithium metal is described. A synthetic investigation has demonstrated the requirements for effective mediation. The electrochemical reduction of the mediators and of the two substrates was studied in THE 0.1 M TBAP, at platinum microelectrodes both at room temperature and at low temperature. The formal potentials, E(t)(0) extracted from the cyclic voltammograms, are in agreement with results of the synthetic Study and computational calculations also provide a correlation. (C) 2009 Elsevier Ltd. All rights reserved.