N-butylanilinium chloride | 2492-82-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N-butylanilinium chloride
• 英文别名: N-butyl-aniline; hydrochloride；N-Butyl-anilin; Hydrochlorid；Butyl(phenyl)azanium;chloride；butyl(phenyl)azanium;chloride
• CAS: 2492-82-2
• 化学式: C₁₀H₁₅N*ClH
• 分子量: 185.697
• InChiKey: NBISWBAUMGDCJO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.32
• 重原子数：
  12
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  12
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  potassium thioacyanate 、 N-butylanilinium chloride 在 水 作用下， 生成 n-丁基-n-苯基硫脲
  参考文献：
  名称：

  de Beer et al., Journal of Pharmacology and Experimental Therapeutics, 1936, vol. 57, p. 19,22

  摘要：

  DOI：
• 作为产物：
  描述：

  1,1,1-三甲基-N-苯基哌啶 、 1-碘丁烷 、 正丁基锂 、 四氢呋喃 、 盐酸 以65%的产率得到
  参考文献：
  名称：

  CALVERLEY, M. J., SYNTH. COMMUN., 1983, 13, N 7, 601-609

  摘要：

  DOI：

文献信息

• Particularly substituted thiazolesulfenamides
  申请人：UOP Inc.

  公开号：US04041043A1

  公开（公告）日：1977-08-09

  Novel compounds comprising N-phenyl-N-R-benzothiazole-2-sulfenamides in which R is an akyl radical or cycloalkyl radical are useful as rubber additives.

  含有N-苯基-N-R-苯并噻唑-2-磺酰胺的新化合物，其中R是烷基或环烷基基团，可用作橡胶添加剂。
• AROMATIC AMINE DERIVATIVES, SOLUBLE CONDUCTIVE COMPOUND, AND ELECTROLUMINESCENT ELEMENT
  申请人：Nissan Chemical Industries, Ltd.

  公开号：EP1156072A1

  公开（公告）日：2001-11-21

  An aromatic amine derivative of the following general formula (1) is useful to form an auxiliary carrier transporting layer in an electroluminescent device. R1 is a monovalent hydrocarbon group or organooxy group, and A and B have the following general formula (2) or (3).

  以下通式（1）的芳香胺衍生物可用于在电致发光器件中形成辅助载流子传输层。 R1 是一价烃基或有机氧基，A 和 B 具有以下通式（2）或（3）。
• Structure−Activity Relationships and Effects on Neuroactive Steroid Synthesis in a Series of 2-Phenylimidazo[1,2-<i>a</i>]pyridineacetamide Peripheral Benzodiazepine Receptors Ligands
  作者：Giuseppe Trapani、Valentino Laquintana、Nunzio Denora、Adriana Trapani、Angela Lopedota、Andrea Latrofa、Massimo Franco、Mariangela Serra、Maria Giuseppina Pisu、Ivan Floris、Enrico Sanna、Giovanni Biggio、Gaetano Liso

  DOI：10.1021/jm049610q

  日期：2005.1.1

  A series of 36 imidazopyridineacetamides (2-37) were designed and synthesized to evaluate the effects of structural changes on the amide nitrogen at both central (CBRs) and peripheral benzodiazepine receptors (PBRs). These changes include variations in the length and number of the alkyl groups as well as introduction of different aromatic, heteroaromatic, and conformationally constrained groups. The affinities of these compounds for CBRs and PBRs were determined, and the results indicate that bulkiness of the substituents, their branching, and length beyond an optimal value may cause hindrance to the ligand in its interaction with the receptor. The presence of aromatic or conformationally constrained substituents on the carboxamide nitrogen can be conducive to high affinity and selectivity. Furthermore, the ability of a subset of the most active ligands to stimulate synthesis of neuroactive steroids in plasma and brain was evaluated in vivo and in vitro. Compound 3 exhibited very marked effects on the peripheral and central synthesis of neuroactive steroids, while 36 (potent at subnanomolar level) showed a slight ability to affect neuroactive steroid content in the cerebral cortex.
• Reilly; Hickinbottom, Journal of the Chemical Society, 1920, vol. 117, p. 133
  作者：Reilly、Hickinbottom

  DOI：——

  日期：——
• Hickinbottom, Journal of the Chemical Society, 1927, p. 66
  作者：Hickinbottom

  DOI：——

  日期：——