p-(3-methyl-3-hydroxy-1-butynyl)-N,N-dibenzylaniline | 82815-79-0

• 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: p-(3-methyl-3-hydroxy-1-butynyl)-N,N-dibenzylaniline
• 英文别名: p-(3-methyl-1-butyn-3-ol)-N,N-dibenzylaniline；4-[4-(Dibenzylamino)phenyl]-2-methylbut-3-yn-2-ol
• CAS: 82815-79-0
• 化学式: C₂₅H₂₅NO
• 分子量: 355.48
• InChiKey: NMOWXCBCTOZSOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  23.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  p-(3-methyl-3-hydroxy-1-butynyl)-N,N-dibenzylaniline 在 氢氧化钾 作用下， 以 甲苯 为溶剂， 以90%的产率得到4-(N,N-dibenzylamino)-1-ethynylbenzene
  参考文献：
  名称：

  Photochemistry of acetylene derivatives of aromatic amines 2. Photolysis of p-ethynyl- and p-butadiynyl-N,N-dibenzylanilines and p-dimethylaminotolane in the presence of carbon tetrachloride and oxygen

  摘要：

  The radical-cations of alkynylanilines are formed during the photolysis of ethynylanilines substituted at the para position in the presence of carbon tetrachloride and oxygen. They undergo two types of reaction, i.e., ejection of the alkyl substituent from the amino group and addition of the H atom from the amine molecule or the Cl atom from the carbon tetrachloride to the triple bond of the radical-cation. In the radical-cation of p-butadiynyl-N,N-dibenzylaniline not only the N-Alk but also the N-Ar bond is cleaved. The mass spectra of the products from the photolysis of all the investigated alkynylarylamines were obtained and analyzed.

  DOI：

  10.1007/bf00961695
• 作为产物：
  描述：

  N,N-二苄基苯胺 在 bis-triphenylphosphine-palladium(II) chloride 、 copper(l) iodide 、 碘 、 碳酸氢钠 、 二乙胺 作用下， 以 甲醇 为溶剂， 反应 6.0h， 生成 p-(3-methyl-3-hydroxy-1-butynyl)-N,N-dibenzylaniline
  参考文献：
  名称：

  Acetylenic derivatives of aniline

  摘要：

  DOI：

  10.1007/bf00949973

文献信息

• BARDAMOVA, M. I.;USOV, O. M., IZV. AN CCCP. CEP. XIM.,(1990) N, S. 1091-1098
  作者：BARDAMOVA, M. I.、USOV, O. M.

  DOI：——

  日期：——
• BARDAMOVA, M. I.;TROTSENKO, Z. P.;KOTLYAREVSKIJ, I. L., IZV. AN CCCP. CEP. XIM., 1982, N 5, 1184-1186
  作者：BARDAMOVA, M. I.、TROTSENKO, Z. P.、KOTLYAREVSKIJ, I. L.

  DOI：——

  日期：——
• Acetylenic derivatives of aniline
  作者：M. I. Bardamova、Z. P. Trotsenko、I. L. Kotlyarevskii

  DOI：10.1007/bf00949973

  日期：1982.5
• Photochemistry of acetylene derivatives of aromatic amines 2. Photolysis of p-ethynyl- and p-butadiynyl-N,N-dibenzylanilines and p-dimethylaminotolane in the presence of carbon tetrachloride and oxygen
  作者：M. I. Bardamova、O. M. Usov

  DOI：10.1007/bf00961695

  日期：1990.5

  The radical-cations of alkynylanilines are formed during the photolysis of ethynylanilines substituted at the para position in the presence of carbon tetrachloride and oxygen. They undergo two types of reaction, i.e., ejection of the alkyl substituent from the amino group and addition of the H atom from the amine molecule or the Cl atom from the carbon tetrachloride to the triple bond of the radical-cation. In the radical-cation of p-butadiynyl-N,N-dibenzylaniline not only the N-Alk but also the N-Ar bond is cleaved. The mass spectra of the products from the photolysis of all the investigated alkynylarylamines were obtained and analyzed.