2-[[4-[(2-carbonochloridoylphenoxy)methyl]phenyl]methoxy]benzoyl chloride | 856685-36-4

• 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: 2-[[4-[(2-carbonochloridoylphenoxy)methyl]phenyl]methoxy]benzoyl chloride
• CAS: 856685-36-4
• 化学式: C₂₂H₁₆Cl₂O₄
• 分子量: 415.273
• InChiKey: RRODXIFKVYSLNJ-UHFFFAOYSA-N

物化性质

• 沸点：
  570.4±40.0 °C(Predicted)
• 密度：
  1.332±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  28.0
• 可旋转键数：
  8.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  52.6
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  2-[[4-[(2-carbonochloridoylphenoxy)methyl]phenyl]methoxy]benzoyl chloride 、 [o-phenylenebis(methylenethio)]dianiline 在 三乙胺 作用下， 以 氯仿 为溶剂， 反应 12.0h， 以50%的产率得到18,25-Dioxa-3,40-dithia-10,33-diazaheptacyclo[40.2.2.220,23.04,9.012,17.026,31.034,39]octatetraconta-1(45),4,6,8,12,14,16,20,22,26,28,30,34,36,38,42(46),43,47-octadecaene-11,32-dione
  参考文献：
  名称：

  Synthesis, characterization and ion transportation studies of some novel cyclophane amides

  摘要：

  Various novel cyclophane amides with a large cavity have been synthesized. The structures of cyclophane amides 14 and 15 were resolved using XRD studies. Cyclophane amide 28 shows a shift in lambda(max) in the UV/Vis. spectra when treated with Cu (II) ion as well as with Ph(II) ion. Ion transportation studies were carried out with cyclophane amide 14 which proved that the Na+ ion passes through the cavity while K+ ions are retained. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2005.03.064
• 作为产物：
  描述：

  1,4-bis(o-carbomethoxyphenoxymethyl)benzene 在 氢氧化钾 、 氯化亚砜 、 三乙胺 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 反应 2.0h， 生成 2-[[4-[(2-carbonochloridoylphenoxy)methyl]phenyl]methoxy]benzoyl chloride
  参考文献：
  名称：

  Synthesis, characterization and ion transportation studies of some novel cyclophane amides

  摘要：

  Various novel cyclophane amides with a large cavity have been synthesized. The structures of cyclophane amides 14 and 15 were resolved using XRD studies. Cyclophane amide 28 shows a shift in lambda(max) in the UV/Vis. spectra when treated with Cu (II) ion as well as with Ph(II) ion. Ion transportation studies were carried out with cyclophane amide 14 which proved that the Na+ ion passes through the cavity while K+ ions are retained. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2005.03.064

文献信息

• Synthesis, characterization, and anti-bacterial efficacy of some novel cyclophane amide
  作者：Perumal Rajakumar、A. Mohammed Abdul Rasheed、P.M. Balu、K. Murugesan

  DOI：10.1016/j.bmc.2006.07.020

  日期：2006.11

  Synthesis of macrocyclic di, tetra- and hexaamides with aza and oxy linkages has been achieved and the inhibitory activity of cyclophane amides against human pathogenic bacteria well documented. (c) 2006 Elsevier Ltd. All rights reserved.