5-hydroxymethyl-1,4-diazabicyclo[2.2.2]octane-2-methanol

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 5-hydroxymethyl-1,4-diazabicyclo[2.2.2]octane-2-methanol
• 英文别名: [5-(Hydroxymethyl)-1,4-diazabicyclo[2.2.2]octan-2-yl]methanol；[5-(hydroxymethyl)-1,4-diazabicyclo[2.2.2]octan-2-yl]methanol
• 化学式: C₈H₁₆N₂O₂
• 分子量: 172.227
• InChiKey: SWLMVPDUBVTPTK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.4
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  46.9
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  哌嗪-2-甲醇 、 3-氯-1,2-丙二醇 在 The catalyst comprising aluminium phosphate , sodium sulfate, and graphite 作用下， 以 甲醇 、 水 为溶剂， 反应 9.0h， 以4%的产率得到3-hydroxy-6-hydroxymethyl-1,5-diazabicyclo[3.2.2]nonane
  参考文献：
  名称：

  CYCLIC AMINE COMPOUND, AND PROCESS FOR PRODUCING POLYURETHANE RESIN USING SAME

  摘要：

  公开号：

  EP2657237B1

文献信息

• NOVEL CYCLIC AMINE COMPOUND, AND PROCESS FOR PRODUCING POLYURETHANE RESIN USING SAME
  申请人：Tosoh Corporation

  公开号：EP2657237A1

  公开（公告）日：2013-10-30

  To provide a novel cyclic amine compound and a process for producing a polyurethane resin by using it. A3-hydroxy-1,5-diazabicyclo[3.2.2]nonane represented by the following formula (1), and a process for producing a polyurethane resin by using a catalyst for producing a polyurethane resin, which contains the 3-hydroxy-1,5-diazabicyclo[3.2.2]nonane. When the compound represented by the formula (1) has optical isomers, diastereomers or geometric isomers, the compound includes both a mixture of any of them and an isolated isomer of any of them. [in the above formula (1), each of R1, R2, R3, R4, R5, R6, R7 and R8 which are independent of one another, is a hydrogen atom, a C1-4 alkyl group, a hydroxy group, a hydroxymethyl group or a C1-4 alkoxy group.]

  提供一种新型环胺化合物和一种使用该化合物生产聚氨酯树脂的工艺。提供一种由下式（1）代表的 A3-羟基-1,5-二氮杂双环[3.2.2]壬烷，以及一种通过使用含有 3-羟基-1,5-二氮杂双环[3.2.2]壬烷的生产聚氨酯树脂的催化剂生产聚氨酯树脂的工艺。当式（1）所代表的化合物具有光学异构体、非对映异构体或几何异构体时，该化合物既包括其中任一异构体的混合物，也包括其中任一异构体的分离异构体。 [在上式（1）中，相互独立的 R1、R2、R3、R4、R5、R6、R7 和 R8 各为氢原子、C1-4 烷基、羟基、羟甲基或 C1-4 烷氧基。］
• Catalyst composition for producing polyurethane foam, and method for producing flexible polyurethane foam using it
  申请人：TOSOH CORPORATION

  公开号：US11059932B2

  公开（公告）日：2021-07-13

  To provide a catalyst composition to obtain a flexible polyurethane foam from which substantially no amine compound is discharged and which has sufficient resistance to compressive strain, and a method for producing a flexible polyurethane foam using the catalyst composition. A polyurethane foam is produced by using a catalyst composition for producing a polyurethane foam, which comprises an amine compound represented by the following formula (1) and at least one glycol selected from the group consisting of ethylene glycol and polyethylene glycol, provided that when the compound of the formula (1) has enantiomers, diastereomers or geometric isomers, both a mixture thereof and isolated isomers are included: wherein R1, R2, R3 and R4 are each independently a hydrogen atom, a C1-4 alkyl group, a hydroxy group, a hydroxymethyl group or a C1-4 alkoxy group, and m is an integer of 1 or 2.

  提供一种催化剂组合物，以获得基本上不排出胺化合物且具有足够抗压应变能力的软质聚氨酯泡沫塑料，并提供一种使用该催化剂组合物生产软质聚氨酯泡沫塑料的方法。 使用一种用于生产聚氨酯泡沫塑料的催化剂组合物生产聚氨酯泡沫塑料，该组合物包括由下式（1）表示的胺化合物和至少一种选自乙二醇和聚乙二醇组成的组的乙二醇，条件是当式（1）化合物具有对映体、非对映体或几何异构体时，既包括其混合物，也包括分离的异构体： 其中 R1、R2、R3 和 R4 各自独立地为氢原子、C1-4 烷基、羟基、羟甲基或 C1-4 烷氧基，且 m 为 1 或 2 的整数。
• NOVEL CYCLIC AMINE COMPOUND AND PROCESS FOR PRODUCING POLYURETHANE RESIN BY USING IT
  申请人：Kiso Hiroyuki

  公开号：US20130289232A1

  公开（公告）日：2013-10-31

  To provide a novel cyclic amine compound and a process for producing a polyurethane resin by using it. A 3-hydroxy-1,5-diazabicyclo[3.2.2]nonane represented by the following formula (1), and a process for producing a polyurethane resin by using a catalyst for producing a polyurethane resin, which contains the 3-hydroxy-1,5-diazabicyclo[3.2.2]nonane. When the compound represented by the formula (1) has optical isomers, diastereomers or geometric isomers, the compound includes both a mixture of any of them and an isolated isomer of any of them. [in the above formula (1), each of R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 and R 8 which are independent of one another, is a hydrogen atom, a C 1-4 alkyl group, a hydroxy group, a hydroxymethyl group or a C 1-4 alkoxy group.]
• CATALYSTS FOR PRODUCING POLYURETHANES
  申请人：Momentive Performance Materials GmbH

  公开号：US20210332211A1

  公开（公告）日：2021-10-28

  A tertiary amine compound is shown and described herein. The tertiary amine is a reaction product of an isocyanate and a compound bearing an active hydrogen and a bicyclic tertiary amine in its molecule. The tertiary amine compounds have been found to be suitable as catalysts for producing polyurethanes. Also shown and described are processes employing the tertiary amine compounds in a reaction of an isocyanate and an alcohol in the presence of the tertiary amine compounds. Further, also shown and described is a method for making the tertiary amine.
• US9657129B2
  申请人：——

  公开号：US9657129B2

  公开（公告）日：2017-05-23