| 40233-44-1

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• CAS: 40233-44-1
• 化学式: C₁₁H₁₂ClNO
• 分子量: 209.675
• InChiKey: BHRQSXQCSWUXLZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.35
• 重原子数：
  14.0
• 可旋转键数：
  2.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  20.31
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  在 sodium methylate 作用下， 以 甲醇 、 二氯甲烷 为溶剂， 生成 N,N-dimethyl(O-ethyl)phenylpropioamidium tetrafluoroborate
  参考文献：
  名称：

  Synthesis and cycloaddition reactions of acetylenic iminium compounds

  摘要：

  DOI：

  10.1021/jo00864a001
• 作为产物：
  描述：

  二氯亚甲基二甲基氯化铵 、 苯乙酮 在 水 作用下， 生成
  参考文献：
  名称：

  Iminiumsalze in quantitativen Gas/Festk�per- und Festk�rper/Festk�rper-Reaktionen

  摘要：

  Iminium salts that are highly susceptible to hydrolysis are quantitatively prepared and reacted in the solid state without solvents or liquid phases. Atomic force microscopy AFM helps in elucidating the mechanism of these still unusual gas-solid and solid-solid syntheses by recording surface topographies of reacting crystals of L-histidine (10) and triphenylverdazyl (15). Various imines add gaseous HCl or HBr to form stable iminium halides (1, 3, 4, 5, 11) even if frozen liquids of very weak heterocyclic bases are treated at low temperatures. Another way for quantitative yields of iminium salt hydrates (6) starts with solid primary ammonium halides and gaseous acetone. o-Phenylenediamines (7) give quantitatively 1,5-benzodiazepines (9) by solid state cyclization of bis-iminium salt intermediates (8). Crystalline nitroxyls (12) and triphenylverdazyl (15) undergo stoichiometric one-electron transfer with gaseous NO2 or XeF2 to give nitrosonium (14) and azonium salts (17). The solid state chlorination of tetramethylthiuramdisulfide (18) or dimethylthiocarbamoylchloride (20) yields phosgene dimethyliminiumchloride (Viehe salt 21) in quantitative yield. Solid Viehe salt is quantitatively treated with gaseous Cl-2 to give the trichloride 19 and solid SbCl5 or PCl5 to produce the hexachloroantimoniates (22), -phosphates (23). Solid brenzcatechol (24), mercaptobenzimidazole (27), p-nitroaniline (30), N-methyl benzothiazolone-2-hydrazone (34) and acetophenone (41) are treated with 21 to give the corresponding chloroiminium salts (25, 28, 31, 35, 43). p-Toluenesulfonamide (37) and 22 give the chloroiminium salt 38. These quantitative solid-solid reactions are most easily run in ball mills with cooling device. The "waste-free" techniques achieve exclusion of moisture in an elegant way. The preparative use of the versatile products with nucleophiles is indicated. The three-step solid-state mechanisms are discussed.

  DOI：

  10.1002/prac.19983400409

文献信息

• Unsymmetrical alkenes by carbene coupling from diazirine decomposition in the presence of diazo compounds
  作者：Michael P. Doyle、Alvaro H. Devia、Kathlene E. Bassett、Jan W. Terpstra、Surendra N. Mahapatro

  DOI：10.1021/jo00384a049

  日期：1987.4