4-chloro-N-isopropylbenzimidoyl chloride | 39887-80-4

• 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: 4-chloro-N-isopropylbenzimidoyl chloride
• 英文别名: N-isopropyl 4-chlorobenzimidoyl chloride；N-Isopropyl-4-chlorbenzimidylchlorid；4-chloro-N-propan-2-ylbenzenecarboximidoyl chloride
• CAS: 39887-80-4
• 化学式: C₁₀H₁₁Cl₂N
• 分子量: 216.11
• InChiKey: MTUSDEZULOZFLA-UHFFFAOYSA-N

物化性质

• 沸点：
  277.8±42.0 °C(Predicted)
• 密度：
  1.15±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  12.4
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  4-chloro-N-isopropylbenzimidoyl chloride 在 三甲基乙腈 、 CpRu(PiPr3)(CH3CN)2PF6 、 二甲基苯基硅烷 作用下， 以 二氯甲烷-D2 为溶剂， 反应 0.83h， 生成 N-(2-propyl)-4-chlorobenzylideneamine
  参考文献：
  名称：

  Semi-catalytic reduction of secondary amides to imines and aldehydes

  摘要：

  钌催化的HSiMe2Ph还原亚胺酰氯，实现了将二级酰胺转化为亚胺和醛的两步反应。

  DOI：

  10.1039/c4dt00372a
• 作为产物：
  描述：

  4-氯-N-异丙基苯甲酰胺 在 五氯化磷 作用下， 以 二氯甲烷 为溶剂， 以79%的产率得到4-chloro-N-isopropylbenzimidoyl chloride
  参考文献：
  名称：

  Semi-catalytic reduction of secondary amides to imines and aldehydes

  摘要：

  钌催化的HSiMe2Ph还原亚胺酰氯，实现了将二级酰胺转化为亚胺和醛的两步反应。

  DOI：

  10.1039/c4dt00372a

文献信息

• METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES
  申请人：Nikonov Georgii

  公开号：US20140228579A1

  公开（公告）日：2014-08-14

  The present application relates to methods for the catalytic reduction of acid chlorides and/or imidoyl chlorides. The methods comprise reacting the acid chloride or imidoyl chloride with a silane reducing agent in the presence of a catalyst such as [Cp(Pr i 3 P)Ru(NCMe) 2 ] + [PF 6 ] − .

  本申请涉及用于催化还原酸氯化物和/或亚胺酰氯化物的方法。该方法包括在催化剂的存在下，将酸氯化物或亚胺酰氯化物与硅烷还原剂反应，所述催化剂例如为[Cp(Pr i 3 P)Ru(NCMe) 2 ] + [PF 6 ] − 。
• Imidoyl substituted pyrroles
  申请人：McNeilab, Inc.

  公开号：US04528382A1

  公开（公告）日：1985-07-09

  Novel compounds, which are aryl-pyrrolyl-imine derivatives of the Formula I ##STR1## and acid addition salts thereof are disclosed; which compounds may be prepared by the acid catalyzed condensation of an imidoyl chloride with a lower alkyl pyrrole-2-acetate; and which compounds are useful as intermediates to form by hydrolysis, the known useful ketone analogs which have anti-inflammatory and analgesic activity; and certain of which compounds have antisecretory, anti-irritable bowel, antidiarrheal and general behavior effect on the CNS properties.

  揭示了一种新的化合物，即Formula I的芳基-吡咯基-亚胺衍生物及其酸盐加合物；这些化合物可以通过酸催化的方法制备，将亚胺酰氯与较低的烷基吡咯-2-乙酸酯进行缩合；这些化合物可作为中间体，通过水解形成已知的有益酮类似物，具有抗炎和镇痛活性；其中一些化合物具有抗分泌、抗肠道刺激、止泻和对中枢神经系统具有一般行为影响的特性。
• Aromatic substituted amidines
  申请人：STERLING DRUG INC.

  公开号：US03850909A1

  公开（公告）日：1974-11-26
• Cawkill, Eric; Clark, Nigel G., Journal of the Chemical Society. Perkin transactions I, 1980, p. 244 - 248
  作者：Cawkill, Eric、Clark, Nigel G.

  DOI：——

  日期：——
• Synthesis of Chlorinated Bicyclic C-Fused Tetrahydrofuro[3,2-<i>c</i>]azetidin-2-ones
  作者：Ram N. Ram、Neeraj Kumar、Nem Singh

  DOI：10.1021/jo101045z

  日期：2010.11.5

  Some bicyclic C-fused chlorinated tetrahydrofuro[3,2-c]azetidin-2-ones were prepared by a fairly general route involving Staudinger reaction of allylic/propargylic imidates with dichloroketene followed by highly diastereoselective CuCl/PMDETA-catalyzed 5-exo-trig/dig chlorine atom transfer radical cyclization. An oxepan-fused beta-lactam was also prepared similarly by 7-endo-trig cyclization. Synthetic application of the side chain chlorine atom of the products was demonstrated by its substitution in one of the products with azide followed by azide-alkyne click reaction with phenylacetylene to obtain a 1,2,3-triazolyltetrahydrofuro[3,2-c]azetidin-2-one.