1-chloro-2-(4-dimethylaminophenyl)ethane | 56153-00-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1-chloro-2-(4-dimethylaminophenyl)ethane
• 英文别名: 4-(2-chloroethyl)-N,N-dimethylaniline；β-(4-Dimethylaminophenyl)-aethylchlorid；4-(2-Chloroethyl)-N,N-dimethylbenzenamine
• CAS: 56153-00-5
• 化学式: C₁₀H₁₄ClN
• 分子量: 183.681
• InChiKey: JAJYJABMCMDWHA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  12
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-chloro-2-(4-dimethylaminophenyl)ethane 、 2-(4-哌啶)-1H-苯并咪唑 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 16.0h， 生成 4-[2-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]ethyl]-N,N-dimethylaniline
  参考文献：
  名称：

  Orjales; Bordell; Rubio, Journal of Heterocyclic Chemistry, 1995, vol. 32, # 3, p. 707 - 718

  摘要：

  DOI：
• 作为产物：
  描述：

  4-(二甲基氨基)苯乙醇 在 氯化亚砜 作用下， 生成 1-chloro-2-(4-dimethylaminophenyl)ethane
  参考文献：
  名称：

  Elimination mechanisms. Deuteroxide/hydroxide isotope effects as a measure of proton transfer in the transition states for E2 elimination of 2-(p-trimethylammoniophenyl)ethyl 'Onium ions and halides. Mapping of the reaction-coordinate motion

  摘要：

  DOI：

  10.1021/ja00844a030

文献信息

• Chemoselective Homologation–Deoxygenation Strategy Enabling the Direct Conversion of Carbonyls into (<i>n+1</i>)-Halomethyl-Alkanes
  作者：Margherita Miele、Andrea Citarella、Thierry Langer、Ernst Urban、Martin Zehl、Wolfgang Holzer、Laura Ielo、Vittorio Pace

  DOI：10.1021/acs.orglett.0c02831

  日期：2020.10.2

  The sequential installation of a carbenoid and a hydride into a carbonyl, furnishing halomethyl alkyl derivatives, is reported. Despite the employment of carbenoids as nucleophiles in reactions with carbon-centered electrophiles, sp3-type alkyl halides remain elusive materials for selective one-carbon homologations. Our tactic levers on using carbonyls as starting materials and enables uniformly high

  据报道，将类胡萝卜素和氢化物顺序安装在羰基上，提供了卤代甲基烷基衍生物。尽管在与以碳为中心的亲电子试剂的反应中使用类胡萝卜素作为亲核试剂，sp 3型烷基卤化物仍然是用于选择性一碳同系物的难以捉摸的材料。我们的策略是利用羰基化合物作为起始原料，从而能够均匀地实现高收率和化学控制。该策略是灵活的，不仅限于类胡萝卜素。而且，各种类似碳负离子的物种可以充当亲核试剂，因此使其具有普遍的适用性。
• Organocatalytic Chlorination of Alcohols by P(III)/P(V) Redox Cycling
  作者：Lars Longwitz、Stefan Jopp、Thomas Werner

  DOI：10.1021/acs.joc.9b00741

  日期：2019.6.21

  system for the chlorination of alcohols under Appel conditions was developed. Benzotrichloride is used as a cheap and readily available chlorinating agent in combination with trioctylphosphane as the catalyst and phenylsilane as the terminal reductant. The reaction has several advantages over other variants of the Appel reaction, e.g., no additional solvent is required and the phosphane reagent is used

  开发了在Appel条件下用于醇氯化的催化系统。与三辛基膦作为催化剂和苯基硅烷作为末端还原剂结合使用，三氯化苯甲酸酯是一种廉价且易于获得的氯化剂。该反应相对于Appel反应的其他变体具有多个优点，例如，不需要其他溶剂，并且仅以催化量使用膦试剂。总共合成了27种不同的伯，仲和叔烷基氯，收率高达95％。在最佳条件下，也可以将环氧化物和氧杂环丁烷转化为二氯化产物。
• 11-Substituted 5H,11H-pyrrolo[2,1-c][1,4]benzoxazepines, a process for their preparation and their use in medicaments
  申请人：HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED

  公开号：EP0144729A1

  公开（公告）日：1985-06-19

  There are described to novel 11-substituted 5H,11H-pyrrolo[2,1-c] [1,4]benzoxazepines of the general formula where m and n are each independently, 0,1 or 2 and m + n is 1or 2, X and Y are each independently hydrogen, loweralkyl or halogen, and R is hydrogen, cyano, unsubstituted loweralkyl, or substituted loweralkyl having one to three substituents each of which being independently cyano, hydroxy, cyclohexyl, furyl, k being 1, 2 or 3, W being each independently hydrogen, halogen, hydroxy, loweralkyl, trifluoromethyl, loweralkoxy, nitro, amino, diloweralkylamino, phenoxy, or benzyloxy, and Z being hydrogen, loweralkyl or halogen, which are useful as antipsychotic and analgesic agents; novel intermediate compounds therefor; and methods of synthesizing the foregoing compounds.

  描述了通式为 11-取代 5H，11H-吡咯并[2,1-c] [1,4]苯并噁唑杂卓的新化合物 其中m和n各自独立地为0、1或2，m+n为1或2，X和Y各自独立地为氢、低级烷基或卤素，R为氢、氰基、未取代的低级烷基或取代的低级烷基、 未取代的低级烷基，或具有 1 至 3 个取代基的取代低级烷基，每个取代基独立为氰基、羟基、环己基、呋喃基、 k是1、2或3，W各自独立地是氢、卤素、羟基、低级烷基、三氟甲基、低级烷氧基、硝基、氨基、稀低级烷基氨基、苯氧基或苄氧基，Z是氢、低级烷基或卤素，这些化合物可用作抗精神病药和镇痛药；其新型中间体化合物；以及合成上述化合物的方法。
• Additive for nonaqueous electrolyte solutions, nonaqueous electrolyte solution and electricity storage device
  申请人：Sumitomo Seika Chemicals Co., Ltd.

  公开号：US10615456B2

  公开（公告）日：2020-04-07

  Disclosed is an additive for nonaqueous electrolyte solutions, comprising a disulfonic acid amide compound represented by Formula (1). In Formula (1), A represents a CmH(2m-n)Zn, in which m represents an integer of 1 to 6, n represents an integer of 1 to 12, 2m-n is 0 or more, and Z represents a halogen atom, R1, R2, R3, and R4 represent an alkyl group having 1 to 6 carbon atoms which is substituted with a phenyl group optionally having a substituent, or the like, and R1 and R2, and R3 and R4 may be linked respectively to form an alkylene group having 2 to 5 carbon atoms in total which forms a cyclic structure together with a nitrogen atom.

  本发明公开了一种用于非水电解质溶液的添加剂，其中包含一种由式（1）表示的二磺酸酰胺化合物。 在式 (1) 中，A 代表 CmH(2m-n)Zn，其中 m 代表 1 至 6 的整数，n 代表 1 至 12 的整数，2m-n 为 0 或更多，Z 代表卤素原子，R1、R2、R3 和 R4 代表具有 1 至 6 个碳原子的烷基，该烷基被任选具有取代基的苯基取代、或类似物，R1 和 R2 以及 R3 和 R4 可分别连接成总共具有 2 至 5 个碳原子的亚烷基，该亚烷基与氮原子一起形成环状结构。
• ADDITIVE FOR NONAQUEOUS ELECTROLYTE SOLUTIONS, NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTRICITY STORAGE DEVICE
  申请人：Sumitomo Seika Chemicals Co., Ltd.

  公开号：US20190181499A1

  公开（公告）日：2019-06-13

  Disclosed is an additive for nonaqueous electrolyte solutions, comprising a disulfonic acid amide compound represented by Formula (1). In Formula (1), A represents a C m H (2m-n) Z n , in which m represents an integer of 1 to 6, n represents an integer of 1 to 12, 2m-n is 0 or more, and Z represents a halogen atom, R 1 , R 2 , R 3 , and R 4 represent an alkyl group having 1 to 6 carbon atoms which is substituted with a phenyl group optionally having a substituent, or the like, and R 1 and R 2 , and R 3 and R 4 may be linked respectively to form an alkylene group having 2 to 5 carbon atoms in total which forms a cyclic structure together with a nitrogen atom.