N,N-bis(1-methylethyl)-1-naphthalenamine | 4960-24-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: N,N-bis(1-methylethyl)-1-naphthalenamine
• 英文别名: 1-(N,N-diisopropylamino)naphthalene；N,N-Diisopropyl-1-naphthylamine；diisopropyl-[1]naphthyl-amine；Diisopropyl-[1]naphthyl-amin；1-Diisopropylamino-naphthalin；N,N-di(propan-2-yl)naphthalen-1-amine
• CAS: 4960-24-1
• 化学式: C₁₆H₂₁N
• 分子量: 227.349
• InChiKey: MHYIRLJJUMFLPO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  1-溴代萘 、 二异丙胺 在 N,N-(bis)cyclohexyldiimine palladium chloride 18-冠醚-6 、 potassium tert-butylate 作用下， 以 甲苯 为溶剂， 反应 24.0h， 以12%的产率得到N,N-bis(1-methylethyl)-1-naphthalenamine
  参考文献：
  名称：

  Iyer, Suresh; Kulkarni, Girish M.; Ramesh, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2005, vol. 44, # 9, p. 1894 - 1908

  摘要：

  DOI：

文献信息

• The anionic thia-Fries rearrangement of aryl triflates
  作者：Jonathan P. H. Charmant、Alan M. Dyke、Guy C. Lloyd-Jones

  DOI：10.1039/b210648e

  日期：2003.1.23

  Aryl triflates undergo LDA-mediated rearrangement to generate o-hydroxyaryl trifluoromethylsulfones. In some cases, partitioning between rearrangement and aryne generation can be controlled.

  芳基三氟甲磺酸酯经历LDA介导的重排，生成邻羟基芳基三氟甲基砜。在某些情况下，可以控制重排和芳烃生成之间的分配。
• Benzyne generation from aryl triflates
  作者：Peter P. Wickham、Kevin H. Hazen、Hong Guo、Garth Jones、Kelly Hardee Reuter、William J. Scott

  DOI：10.1021/jo00006a016

  日期：1991.3

  The use of aryl triflates to form arynes as reactive intermediates is described. This allows the first general use of phenols as aryne precursors. Phenyl triflate reacts with LDA at - 78-degrees-C to form benzyne, which then reacts with diisopropylamine generating N,N-diisopropylaniline. Yields of diisopropylarylamines from aryne intermediates are superior to those previously reported. Regioisomeric ratios are similar to those obtained with use of other benzyne precursors.
• Huisgen; Zirngibl, Chemische Berichte, 1958, vol. 91, p. 2375,2380
  作者：Huisgen、Zirngibl

  DOI：——

  日期：——
• WICKHAM, PETER P.;HAZEN, KEVIN H.;GUO, HONG;JONES, GARTH;REUTER, KELLY HA+, J. ORG. CHEM., 56,(1991) N, C. 2045-2050
  作者：WICKHAM, PETER P.、HAZEN, KEVIN H.、GUO, HONG、JONES, GARTH、REUTER, KELLY HA+

  DOI：——

  日期：——
• [EN] METHOD FOR DETERMINING AUTHENTICITY AND ADULTERATION OF MARKED PETROLEUM HYDROCARBONS<br/>[FR] PROCÉDÉ PERMETTANT DE DÉTERMINER L'AUTHENTICITÉ ET L'ADULTÉRATION D'HYDROCARBURES PÉTROLIERS MARQUÉS
  申请人：SICPA HOLDING SA

  公开号：WO2021110525A1

  公开（公告）日：2021-06-10

  The present invention provides a method for determining the authenticity of a petroleum hydrocarbon allegedly comprising at least one specific chemical marker, as well as a method for determining adulteration of a petroleum hydrocarbon marked with at least one specific chemical marker. The methods claimed and described herein rely upon the use of specific chemical markers in combination with laser ionization at a wavelength of between about 300 nm and about 370 nm coupled with ion mobility spectrometry or with mass spectrometry.