N-methyldicyclohexylamine hydrochloride | 59325-20-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: N-methyldicyclohexylamine hydrochloride
• 英文别名: N,N-dicyclohexylmethylamine hydrochloride；N,N-dicyclohexylmethylammoniumchloride；dicyclohexyl-methyl-amine; hydrochloride；N-cyclohexyl-N-methylcyclohexanamine;hydrochloride
• CAS: 59325-20-1
• 化学式: C₁₃H₂₅N*ClH
• 分子量: 231.809
• InChiKey: FECKGFOXYFBBDR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.01
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  3.2
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  N-甲基二环己基胺 在 盐酸 作用下， 以 乙腈 为溶剂， 生成 N-methyldicyclohexylamine hydrochloride
  参考文献：
  名称：

  三种 N,N-二环己基甲基卤化铵 C13H26N+X− (X = Cl, Br, I) 的晶体结构和 FT-IR 光谱

  摘要：

  摘要 标题化合物 C13H26N+Cl−（N,N-二环己基甲基氯化铵）、C13H26N+Br−（N,N-二环己基甲基溴化铵）和 C13H26N+I−（N,N-二环己基甲基碘化铵）是同构的并在正交空间结晶Pna21 组，晶格参数 a=7.580(1), b=19.072(1), c=9.165(1) Å, V=1324.9(1) Å3 for X=Cl, a=7.765(1), b=19.054 (1), c=9.270(1) Å, V=1371.5(1) Å3 for X=Br, and a=8.102(1), b=19.084(1), c=9.535(1) Å, V=1474.2 (1) X=I 的 Å3，每种化合物的 Z=4。它们的环己基沿 [010] 排列，而它们的卤离子通过强线性 N–H…X (X=Cl, Br, I) 氢键沿 [100] 配位。傅里叶变换红外光谱显示从氯化物到碘化物的氢键受体强度降低。

  DOI：

  10.1515/znb-2018-1192

文献信息

• [EN] BUFFERED IONIC LIQUIDS FOR OLEFIN DIMERIZATION<br/>[FR] LIQUIDES IONIQUES TAMPONNÉS POUR LA DIMÉRISATION DES OLÉFINES
  申请人：CONOCOPHILLIPS CO

  公开号：WO2011112514A1

  公开（公告）日：2011-09-15

  The present invention relates generally to buffered ionic liquids that are very useful for dimerization of olefins, such as isopropene, wherein the buffer is a phosphine or a bismuthine or an arsine or an amine in the presence of a nickel organometailic catalyst. The buffer can be selected from the group consisting of aryl and phenyl compounds of Bi, P, N, As, and Sb, wherein the buffer can contribute to dimer selectivity.

  本发明涉及缓冲离子液体，可用于烯烃二聚化反应，例如丙烯，其中缓冲剂为膦或铋烷或砷烷或胺，在镍有机金属催化剂的存在下非常有用。缓冲剂可从Bi、P、N、As和Sb的芳基和苯基化合物组中选择，其中缓冲剂可以对二聚选择性做出贡献。
• POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYMERIZABLE COMPOSITION CONTAINING THE CATALYST, POLYTHIOURETHANE RESIN OBTAINED FROM THE COMPOSITION, AND METHOD FOR PRODUCING THE RESIN
  申请人：Mitsui Chemicals, Inc.

  公开号：EP2065414A1

  公开（公告）日：2009-06-03

  By using an amine hydrochloride represented by the formula (1) as a catalyst, a polythiourethane resin which is suitably used for a transparent resin for optical use, can be obtained without using an organotin compound which has been conventionally used as a catalyst for polythiourethane resins and without being affected by the acidity of an additive: wherein R1, R2 and R3 independently represent a monovalent or higher valent linear aliphatic, branched aliphatic, cyclic aliphatic or aromatic organic residue which may have a hydroxyl group or an amino group; and R1, R2 and R3 may be arbitrarily bonded to each other to form a ring.

  使用由式（1）表示的胺盐酸盐作为催化剂，可以获得一种适合用于光学用透明树脂 的聚硫氨酸树脂，而无需使用传统上用作聚硫氨酸树脂催化剂的有机锡化合物，也不会 受到添加剂酸性的影响： 其中 R1、R2 和 R3 独立地代表一价或更高价的线性脂肪族、支链脂肪族、环状脂肪族或芳香族有机残基，可带有羟基或氨基；R1、R2 和 R3 可任意地相互键合以形成环。
• N-Methylation of Amines with Methanol at Room Temperature
  作者：Vasily N. Tsarev、Yuna Morioka、Joaquim Caner、Qing Wang、Richiro Ushimaru、Akihiko Kudo、Hiroshi Naka、Susumu Saito

  DOI：10.1021/acs.orglett.5b01063

  日期：2015.5.15

  N-Methylation of amines with methanol proceeds at room temperature in the presence of a silver-loaded titanium dioxide (Ag/TiO2) photocatalyst under UV-vis light irradiation. This method allows facile synthesis/isolation of N-methylamines bearing various functional groups including N-benzyl, N-allyl, N-Boc, hydroxyl, ether, acetal, carboxamide, formamide, and olefin groups.
• POLYMERIZATION CATALYST FOR POLYTHIOURETHANE OPTICAL MATERIAL, POLYMERIZABLE COMPOSITION CONTAINING THE SAME, POLYTHIOURETHANE RESIN OBTAINED FROM THE COMPOSITION, AND PROCESS FOR PRODUCING THE RESIN
  申请人：Kawato Nobuo

  公开号：US20100029890A1

  公开（公告）日：2010-02-04

  By using an amine hydrochloride represented by the formula (1) as a catalyst, a polythiourethane resin which is suitably used for a transparent resin for optical use, can be obtained without using an organotin compound which has been conventionally used as a catalyst for polythiourethane resins and without being affected by the acidity of an additive: wherein R 1 , R 2 and R 3 independently represent a monovalent or higher valent linear aliphatic, branched aliphatic, cyclic aliphatic or aromatic organic residue which may have a hydroxyl group or an amino group; and R 1 , R 2 and R 3 may be arbitrarily bonded to each other to form a ring.
• BUFFERED IONIC LIQUIDS FOR OLEFIN DIMERIZATION
  申请人：Dötterl Matthias

  公开号：US20120136189A1

  公开（公告）日：2012-05-31

  The present invention relates generally to buffered ionic liquids that are very useful for dimerization of olefins, such as isopropene, wherein the buffer is a phosphine or a bismuthine or an arsine or an amine.