1-chloro-4-(3-dimethylaminophenoxy)butane | 143916-45-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1-chloro-4-(3-dimethylaminophenoxy)butane
• 英文别名: 3-(4-Chlorobutoxy)-N,N-dimethylaniline
• CAS: 143916-45-4
• 化学式: C₁₂H₁₈ClNO
• 分子量: 227.734
• InChiKey: VRTOVALPKXFPRU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  4-氯丁醇 、 3-羟基-N,N-二甲基苯胺 在 sodium ethanolate 作用下， 生成 1-chloro-4-(3-dimethylaminophenoxy)butane
  参考文献：
  名称：

  Derivatives of tetrahedral boronic acids

  摘要：

  A series of aliphatic and benzylic bifunctional boronate esters have been prepared as potential ligands for affinity chromatography. Alpha-Acetamido, picolino, thioureido and acetamidino boronates have the hetero atom coordinated with the boron, creating a tetrahedral structure. The H-1, C-13 and B-11 NMR for these compounds confirm the structure, as well as the hetero atom-boron coordination, and show that the bonding of the internal Lewis base with boron increases in order of coordination strength: pyridine < acetamido < thiourea < acetamidine. Bifunctional boronate esters containing these alpha-substituents and phenoxy ether or dimethylaminophenoxy ether groups, which can be coupled to a solid matrix via a diazonium bond, were prepared.

  DOI：

  10.1016/0022-328x(92)83330-k

文献信息

• [DE] NEUE 1,4-DISUBSTITUIERTE PIPERIDIN-DERIVATE ALS AUF DEN GLUTAMAT-REZEPTOR WIRKENDE ARZNEIMITTEL<br/>[EN] NEW 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES USEFUL AS MEDICAMENTS ACTING ON THE GLUTAMATE RECEPTOR<br/>[FR] NOUVEAUX DERIVES DE PIPERIDINE 1,4-DISUBSTITUES UTILES COMME MEDICAMENTS AGISSANT SUR LE RECEPTEUR DU GLUTAMATE
  申请人：SCHERING AKTIENGESELLSCHAFT

  公开号：WO1995025721A1

  公开（公告）日：1995-09-28

  (DE) Es werden Verbindungen der Formel (I) sowie deren Herstellung und Verwendung in Arzneimitteln beschrieben.(EN) Compounds having the formula (I) are disclosed, as well as their preparation and use in medicaments.(FR) L'invention concerne des composés ayant la formule (I), ainsi que leur préparation et leur utilisation dans des médicaments.

  包含结构式 (I) 的化合物及其在药品中的制备与用途被描述。
• NEUE 1,4-DISUBSTITUIERTE PIPERIDIN-DERIVATE ALS AUF DEN GLUTAMAT-REZEPTOR WIRKENDE ARZNEIMITTEL
  申请人：SCHERING AKTIENGESELLSCHAFT

  公开号：EP0751936A1

  公开（公告）日：1997-01-08
• Derivatives of tetrahedral boronic acids
  作者：Marek Biedrzycki、William H. Scouten、Zenobia Biedrzycka

  DOI：10.1016/0022-328x(92)83330-k

  日期：1992.7

  A series of aliphatic and benzylic bifunctional boronate esters have been prepared as potential ligands for affinity chromatography. Alpha-Acetamido, picolino, thioureido and acetamidino boronates have the hetero atom coordinated with the boron, creating a tetrahedral structure. The H-1, C-13 and B-11 NMR for these compounds confirm the structure, as well as the hetero atom-boron coordination, and show that the bonding of the internal Lewis base with boron increases in order of coordination strength: pyridine < acetamido < thiourea < acetamidine. Bifunctional boronate esters containing these alpha-substituents and phenoxy ether or dimethylaminophenoxy ether groups, which can be coupled to a solid matrix via a diazonium bond, were prepared.