2-氯-n-(4-二乙基氨基-苯基)-乙酰胺 | 125983-31-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 2-氯-n-(4-二乙基氨基-苯基)-乙酰胺
• 英文名称: chloro-acetic acid-(4-diethylamino-anilide)
• 英文别名: N.N-Diaethyl-N'-chloracetyl-p-phenylendiamin；Chlor-essigsaeure-(4-diaethylamino-anilid)；2-Chloro-N-(4-diethylamino-phenyl)-acetamide；2-chloro-N-[4-(diethylamino)phenyl]acetamide
• CAS: 125983-31-5
• 化学式: C₁₂H₁₇ClN₂O
• mdl: MFCD00791331
• 分子量: 240.733
• InChiKey: JZMFUUOPDUHKBZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.416
• 拓扑面积：
  32.3
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2924299090

反应信息

• 作为反应物：
  描述：

  2-氯-n-(4-二乙基氨基-苯基)-乙酰胺 在 sodium hydride 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 为溶剂， 反应 14.0h， 生成 N,N-Diethyl-N'-methyl-N'-(2-phenyl-thiazol-4-yl)-benzene-1,4-diamine
  参考文献：
  名称：

  合成的小分子，诱导成年海马神经祖细胞的神经元分化。

  摘要：

  DOI：

  10.1002/anie.200503089
• 作为产物：
  描述：

  氯乙酰氯 、 N,N-二乙基对苯二胺 在 溶剂黄146 作用下， 生成 2-氯-n-(4-二乙基氨基-苯基)-乙酰胺
  参考文献：
  名称：

  Synthesis and spectral characterisation of new amido-ether Schiff bases

  摘要：

  Series of new compounds prepared by condensing the sodium salt of 4-[(4-methoxy-benzylidene)-amino]phenol with chloroacetanilides carrying various substituents in different positions has been synthesised and characterised by UV-VIS, FTIR, MS, H-1 and C-13 NMR spectrometry. The effect of type and position of different substituents on thermal and on mesomorphic behaviour has been investigated by polarizing optical microscopy and differential scanning calorimetry studies. All compounds possess relatively high phase transition temperatures due to possibility of forming molecular associations and only the 2,4-substituted Ones possess the liquid crystalline behaviour, namely the nematic phase. (C) 2007 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molstruc.2007.11.025

文献信息

• Thiel, W.; Mayer, R., Journal fur praktische Chemie (Leipzig 1954), 1989, vol. 331, # 2, p. 243 - 262
  作者：Thiel, W.、Mayer, R.

  DOI：——

  日期：——
• Jacobs; Heidelberger, Journal of Biological Chemistry, 1915, vol. 21, p. 150
  作者：Jacobs、Heidelberger

  DOI：——

  日期：——
• A Synthetic Small Molecule That Induces Neuronal Differentiation of Adult Hippocampal Neural Progenitor Cells
  作者：Masaki Warashina、Kyung Hoon Min、Tomoko Kuwabara、Alexis Huynh、Fred H. Gage、Peter G. Schultz、Sheng Ding

  DOI：10.1002/anie.200503089

  日期：2006.1.16
• Synthesis and spectral characterisation of new amido-ether Schiff bases
  作者：Oana Stamatoiu、Alexej Bubnov、Isabela Ţârcomnicu、Mircea Iovu

  DOI：10.1016/j.molstruc.2007.11.025

  日期：2008.8

  Series of new compounds prepared by condensing the sodium salt of 4-[(4-methoxy-benzylidene)-amino]phenol with chloroacetanilides carrying various substituents in different positions has been synthesised and characterised by UV-VIS, FTIR, MS, H-1 and C-13 NMR spectrometry. The effect of type and position of different substituents on thermal and on mesomorphic behaviour has been investigated by polarizing optical microscopy and differential scanning calorimetry studies. All compounds possess relatively high phase transition temperatures due to possibility of forming molecular associations and only the 2,4-substituted Ones possess the liquid crystalline behaviour, namely the nematic phase. (C) 2007 Elsevier B.V. All rights reserved.