1,3,5-Tris-(isocyanatomethyl)benzene | 77372-57-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,3,5-Tris-(isocyanatomethyl)benzene
• 英文别名: 1,3,5-triisocyanatomethylbenzene；1,3,5-Tris(isocyanatomethyl)benzene
• CAS: 77372-57-7
• 化学式: C₁₂H₉N₃O₃
• 分子量: 243.222
• InChiKey: HUFIHLDYTVSJID-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  88.3
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N,N'-二环己基-4-吗啉脒 、 1,3,5-Tris-(isocyanatomethyl)benzene 以 二氯甲烷 为溶剂， 以29%的产率得到3-[[3,5-bis[[[cyclohexyl-(N-cyclohexyl-C-morpholin-4-ylcarbonimidoyl)carbamoyl]amino]methyl]phenyl]methyl]-1-cyclohexyl-1-(N-cyclohexyl-C-morpholin-4-ylcarbonimidoyl)urea
  参考文献：
  名称：

  酰基胍类似物的合成：ADP诱导的血小板聚集抑制剂。

  摘要：

  在体外常规筛选抑制ADP诱导的血小板凝集的化合物显示1,1'-六亚甲基双[3-环己基-3-[（环己基氨基）（4-吗啉基）甲基]脲]（1）具有活性并代表具有可能的抗血栓形成活性的双（酰基胍）的第一个例子。为了建立这类化合物的构效关系，我们合成了许多新的双（酰基胍）。这些在体外进行了测试，并且一些类似物也具有活性。离体测试显示化合物22、41、58和70-73在大鼠或豚鼠中具有口服活性。

  DOI：

  10.1021/jm00121a041

文献信息

• HYDROXYMETHYL-CARBOXAMIDO-SUBSTITUTED SILANE AND ITS USE FOR CURABLE, SILANE-TERMINATED POLYMERS
  申请人：SIKA TECHNOLOGY AG

  公开号：US20160159833A1

  公开（公告）日：2016-06-09

  Specific hydroxysilanes of formula (I), a method for the production thereof, the use thereof as a constituent of moisture-curing compositions, and silane-functional compounds produced therefrom, in particular silane-functional polymers and isocyanatosilanes. The hydrosilanes can be produced in a simple process with a high degree of purity and are storage-stable after production. Production from the reaction of lactides with aminosilanes is particularly advantageous. Hydroxysilane of formula (I), where n is 1 or 2.

  公式（I）的特定羟基硅烷，其生产方法，其用作湿固化组合物成分的用途，以及由此产生的硅烷官能化化合物，特别是硅烷官能化聚合物和异氰酸硅烷。这些氢硅烷可以通过简单的过程以高纯度生产，并且在生产后具有储存稳定性。从乳酸酯与氨基硅烷的反应中生产是特别有利的。公式（I）的羟基硅烷，其中n为1或2。
• SILICON-CONTAINING COMPOUND, URETHANE RESIN, STRETCHABLE FILM, AND METHOD FOR FORMING THE SAME
  申请人：SHIN-ETSU CHEMICAL CO., LTD.

  公开号：US20190106528A1

  公开（公告）日：2019-04-11

  The present invention provides a silicon-containing compound shown by the following formula ( 1 ): wherein R 1 , R 2 , R 3 , R 4 , R 5 , and R 6 each independently represent a linear, branched, or cyclic alkyl group having 1 to 6 carbon atoms, a phenyl group, a 3,3,3-trifluoropropyl group, or a group shown by —(OSiR 7 R 8 ) n —OSiR 9 R 10 R 11 ; R 7 , R 8 , R 9 , R 10 , and R 11 have the same meanings as R 1 to R 6 ; X represents a linear or branched alkylene group having 3 to 7 carbon atoms optionally having an ether group; and “n” is an integer in the range of 0 to 100. This provides a stretchable film that hats excellent stretchability and strength, with the film surface having excellent repellency, and a method for forming the same; as well as a urethane resin used for the stretchable film; and a silicon-containing compound to be a material of the urethane resin.

  本发明提供了一种含硅化合物，其化学式如下（1）所示：其中R1、R2、R3、R4、R5和R6分别独立地表示具有1至6个碳原子的直链、支链或环烷基基团，苯基，3,3,3-三氟丙基基团，或者由—(OSiR7R8)n—OSiR9R10R11所示的基团；R7、R8、R9、R10和R11具有与R1至R6相同的含义；X表示具有3至7个碳原子的直链或支链烷基基团，可选地具有醚基；“n”是0至100范围内的整数。这提供了一种具有优异的延展性和强度的可拉伸薄膜，薄膜表面具有优异的防水性，以及形成该薄膜的方法；以及用于可拉伸薄膜的聚氨酯树脂；以及用于聚氨酯树脂的硅含量化合物。
• HYDROXYSILANE AND POLYMER CONTAINING SILANE GROUPS
  申请人：SIKA TECHNOLOGY AG

  公开号：US20160102110A1

  公开（公告）日：2016-04-14

  Special hydroxysilanes, which can be obtained by reacting β-(3,4-epoxycyclohexyl)alkyltrialkoxysilanes with secondary amines, and adducts of the hydroxysilanes in the form of polymers containing silane groups. The hydroxysilanes can be produced having high purity in a simple process and are very stable in storage after production. The polymers containing silane groups that can be obtained by means of the hydroxysilanes have advantageous properties. The polymers enable moisture-curing compositions, which contain no isocyanate groups and which are suitable as elastic adhesives and sealants.

  特殊的羟基硅烷可以通过将β-(3,4-环氧环己基)烷基三烷氧基硅烷与二级胺发生反应获得，并以含硅基团的聚合物形式存在。这些羟基硅烷可以通过简单的工艺制备高纯度，并在生产后储存时非常稳定。通过这些羟基硅烷可以获得具有优越性能的含硅基团的聚合物。这些聚合物使得含有羟基硅烷的水固化组合物成为可能，这些组合物不含异氰酸酯基团，适用于弹性胶粘剂和密封剂。
• ELECTROLYTIC SOLUTION, ELECTROCHEMICAL DEVICE, LITHIUM ION SECONDARY BATTERY, AND MODULE
  申请人：DAIKIN INDUSTRIES, LTD.

  公开号：US20200280096A1

  公开（公告）日：2020-09-03

  An electrolyte solution containing a compound represented by the following formula (1): wherein R 101 and R 102 are the same as or different from each other and are each a hydrogen atom, a fluorine atom, or an alkyl group optionally containing a fluorine atom; and R 103 is an alkyl group or an organic group containing an unsaturated carbon-carbon bond. Also disclosed is an electrochemical device and lithium ion secondary battery including the electrolyte solution, and a module including the electrochemical device or lithium ion secondary battery.

  一种电解质溶液，包含由以下化学式（1）表示的化合物：其中R101和R102彼此相同或不同，分别为氢原子、氟原子或含有氟原子的烷基基团；R103为烷基基团或含有不饱和碳-碳键的有机基团。还公开了包括该电解质溶液的电化学器件和锂离子二次电池，以及包括电化学器件或锂离子二次电池的模块。
• SECONDARY AMINOSILANES
  申请人：SIKA TECHNOLOGY AG

  公开号：US20130281562A1

  公开（公告）日：2013-10-24

  The present disclosure invention relates to novel secondary aminosilanes, a method for producing same, and the use thereof. The secondary aminosilanes can be produced from readily available reactants in a simple manner. The secondary aminosilanes are characterized for example by a low viscosity and are well suited for producing silane-functional polymers that have a low viscosity, fast curing, and good thermal stability.

  本公开的发明涉及新型二次氨基硅烷、其生产方法以及应用。这些二次氨基硅烷可以从易得的反应物中简单地生产出来。这些二次氨基硅烷具有低粘度等特点，非常适合用于生产具有低粘度、快速固化和良好热稳定性的硅烷功能聚合物。