allyl(ethyl)(hexyl)amine | 917970-40-2

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: allyl(ethyl)(hexyl)amine
• 英文别名: N-Ethyl-N-(prop-2-en-1-yl)hexan-1-amine；N-ethyl-N-prop-2-enylhexan-1-amine
• CAS: 917970-40-2
• 化学式: C₁₁H₂₃N
• 分子量: 169.31
• InChiKey: AEAGCMJFLQYYMA-UHFFFAOYSA-N

物化性质

• 沸点：
  207.0±9.0 °C(Predicted)
• 密度：
  0.796±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  12
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  三叔丁基硅烷 、 N,N-二乙基烯丙胺 在 Spaier's catalyst 作用下， 反应 9.0h， 生成 、 allyl(ethyl)(hexyl)amine 、 N,N-二乙基-1-己胺 、 Hexyl-bis(hexylsilyl)silane
  参考文献：
  名称：

  Reaction of hexylsilane with N-substituted allylamine and allyl chloride

  摘要：

  Reactions of allyldiethylamine and allylbis(trimethylsilyl)amine with hexylsilane are studied. The former reaction involves hydrogen evolution and Si-Si bond formation. The contribution of hydrosilylation is insignificant. Substituent exchange between the nitrogen and silicon atoms in the silane is found. In the reaction with allylbis(trimethylsilyl)amine, no evolution of hydrogen is observed, and hydrosilylation takes place. With allyl chloride, hydrosylilation, reduction, and Si-Si bond formation are observed. Quantum-chemical calculations for the reactions with diethylallylamine and allylbis(trimethylsilyl)amine were carried out at the PM3, B3LYP/6-31G**, and B3LYP/LanL2DZ levels to show that these reactions all are thermodynamically allowed, and the difference in the behavior of the amines is explained by kinetic and conformational factors.

  DOI：

  10.1134/s1070363206040086

文献信息

• Home care compositions
  申请人：COLGATE-PALMOLIVE COMPANY

  公开号：US11008533B2

  公开（公告）日：2021-05-18

  Described herein are fabric care compositions comprising an esterquat, and a carbodiimide; along with methods of making and using same.

  本文描述了由酯奎特和碳化二亚胺组成的织物护理组合物，以及制造和使用该组合物的方法。
• HOME CARE COMPOSITIONS
  申请人：Colgate-Palmolive Company

  公开号：EP3884019A1

  公开（公告）日：2021-09-29
• ORGANIC ELECTRONIC MATERIAL, POLYMERIZATION INITIATOR AND THERMAL POLYMERIZATION INITIATOR, INK COMPOSITION, ORGANIC THIN FILM AND PRODUCTION METHOD FOR SAME, ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, LIGHTING DEVICE, DISPLAY ELEMENT, AND DISPLAY DEVICE
  申请人：HITACHI CHEMICAL COMPANY, LTD.

  公开号：US20200143954A1

  公开（公告）日：2020-05-07

  Disclosed is an organic electronic material comprising charge transporting compounds and ionic compounds having electron-accepting properties and high solubility in a solvent. The organic electronic material is characterized by comprising charge transporting compounds and ionic compounds, and in that at least one of the ionic compounds is any one kind of compounds represented by general formulas (1b)-(3b). (In the formulas Y 1 -Y 6 each independently represent a divalent linking group, R 1 -R 6 each independently represent an electron-attracting organic substituent (these structures can further have substituents and hetero-atoms, and R 1 , R 2 and R 3 , or, R 4 -R 6 can respectively combine and become a ring shape or a polymer shape) and L represents a monovalent cation.)
• [EN] HOME CARE COMPOSITIONS<br/>[FR] COMPOSITIONS D'ENTRETIEN
  申请人：COLGATE PALMOLIVE CO

  公开号：WO2020139335A1

  公开（公告）日：2020-07-02

  Described herein are fabric care compositions comprising an esterquat, and a carbodiimide.
• Reaction of hexylsilane with N-substituted allylamine and allyl chloride
  作者：Z. V. Belyakova、P. A. Strozhenko、E. A. Chernyshev、S. P. Knyazev、O. G. Shutova、T. V. Shcherbakova

  DOI：10.1134/s1070363206040086

  日期：2006.4

  Reactions of allyldiethylamine and allylbis(trimethylsilyl)amine with hexylsilane are studied. The former reaction involves hydrogen evolution and Si-Si bond formation. The contribution of hydrosilylation is insignificant. Substituent exchange between the nitrogen and silicon atoms in the silane is found. In the reaction with allylbis(trimethylsilyl)amine, no evolution of hydrogen is observed, and hydrosilylation takes place. With allyl chloride, hydrosylilation, reduction, and Si-Si bond formation are observed. Quantum-chemical calculations for the reactions with diethylallylamine and allylbis(trimethylsilyl)amine were carried out at the PM3, B3LYP/6-31G**, and B3LYP/LanL2DZ levels to show that these reactions all are thermodynamically allowed, and the difference in the behavior of the amines is explained by kinetic and conformational factors.