1,3-Bis(4-isocyanatophenyl)-5,7-dimethyladamantane

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: 1,3-Bis(4-isocyanatophenyl)-5,7-dimethyladamantane
• 英文别名: 1,3-bis(4-isocyanatophenyl)-5,7-dimethyladamantane
• 化学式: C₂₆H₂₆N₂O₂
• 分子量: 398.5
• InChiKey: ZSRCFOVCYDJJFZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  30
• 可旋转键数：
  4
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  58.9
• 氢给体数：
  0
• 氢受体数：
  4

文献信息

• METHOD FOR PRODUCING CYANOGEN-HALIDE, CYANATE ESTER COMPOUND AND METHOD FOR PRODUCING THE SAME, AND RESIN COMPOSITION
  申请人：MITSUBISHI GAS CHEMICAL COMPANY, INC.

  公开号：US20150299110A1

  公开（公告）日：2015-10-22

  A method for efficiently producing a cyanogen halide with suppressed side effects, and a method for producing a high-purity cyanate ester compound at a high yield includes contacting a halogen molecule with an aqueous solution containing hydrogen cyanide and/or a metal cyanide, so that the hydrogen cyanide and/or the metal cyanide is allowed to react with the halogen molecule in the reaction solution to obtain the cyanogen halide, wherein more than 1 mole of the hydrogen cyanide or the metal cyanide is used based on 1 mole of the halogen molecule, and when an amount of substance of an unreacted hydrogen cyanide or an unreacted metal cyanide is defined as mole (A) and an amount of substance of the generated cyanogen halide is defined as mole (B), the reaction is terminated in a state in which (A):(A)+(B) is between 0.00009:1 and 0.2:1.

  一种用于高效生产抑制副作用的氰卤化物，以及以高收率生产高纯度氰酸酯化合物的方法包括将卤素分子与含有氢氰酸和/或金属氰化物的水溶液接触，使得氢氰酸和/或金属氰化物与卤素分子在反应溶液中发生反应以获得氰卤化物，其中基于1摩尔卤素分子使用超过1摩尔的氢氰酸或金属氰化物，当未反应的氢氰酸或未反应的金属氰化物的物质量定义为摩尔(A)，生成的氰卤化物的物质量定义为摩尔(B)，反应在(A)：(A)+(B)介于0.00009:1和0.2:1之间的状态中终止。
• CYANIC ACID ESTER COMPOUND, CURABLE RESIN COMPOSITION CONTAINING SAID COMPOUND, AND CURED PRODUCT THEREOF
  申请人：Mitsubishi Gas Chemical Company, Inc.

  公开号：EP3061745A1

  公开（公告）日：2016-08-31

  There is provided a novel cyanate ester compound which has excellent solvent solubility and provides a hardened product having a low coefficiency of thermal expansion, and excellent flame retardancy and heat resistance. The present invention is a cyanate ester compound represented by the following formula (1): wherein Ar represents an aromatic ring; R1 each independently represents a hydrogen atom, an alkyl group, or an aryl group; n each independently represents an integer of 1 to 3; m + n is the same as the total number of hydrogen atoms in a monovalent aromatic group containing the aromatic ring and the hydrogen atoms; R2 represents a hydrogen atom (excluding a case where Ar represents a benzene ring; n each represents 1; R1 represents a hydrogen atom; m each represents 4, and a cyanate group is bonded to the benzene ring in the 4-position relative to an adamantyl group), or an alkyl group having 1 to 4 carbon atoms; and R3 represents a hydrogen atom or an alkyl group having 1 to 4 carbon atoms.

  本发明提供了一种新型氰酸酯化合物，它具有极佳的溶剂溶解性，可提供热膨胀系数低、阻燃性和耐热性极佳的硬化产品。本发明是由下式（1）表示的氰酸酯化合物： 其中 Ar 代表芳香环；R1 各自独立地代表氢原子、烷基或芳基；n 各自独立地代表 1 至 3 的整数；m + n 与包含芳香环和氢原子的一价芳香基团中氢原子的总数相同；R2 代表氢原子（不包括 Ar 代表苯环的情况；n 各代表 1；R1 代表氢原子；m 各代表 4，相对于金刚烷基，氰酸酯基团键合在苯环的 4 位上）或具有 1 至 4 个碳原子的烷基；以及 R3 代表氢原子或具有 1 至 4 个碳原子的烷基。
• CYANATE ESTER COMPOUND, CURABLE RESIN COMPOSITION CONTAINING THE SAME, AND HARDENED PRODUCT THEREOF
  申请人：MITSUBISHI GAS CHEMICAL COMPANY, INC.

  公开号：US20160262263A1

  公开（公告）日：2016-09-08

  The present invention is a cyanate ester compound represented by the following formula (1): wherein Ar represents an aromatic ring; R 1 each independently represents a hydrogen atom, an alkyl group, or an aryl group; n each independently represents an integer of 1 to 3; m+n is the same as the total number of hydrogen atoms in a monovalent aromatic group containing the aromatic ring and the hydrogen atoms; R 2 represents a hydrogen atom (excluding a case where Ar represents a benzene ring; n each represents 1; R 1 represents a hydrogen atom; m each represents 4, and a cyanate group is bonded to the benzene ring in the 4-position relative to an adamantyl group), or an alkyl group having 1 to 4 carbon atoms; and R 3 represents a hydrogen atom or an alkyl group having 1 to 4 carbon atoms.
• US9475761B2
  申请人：——

  公开号：US9475761B2

  公开（公告）日：2016-10-25
• US9949369B2
  申请人：——

  公开号：US9949369B2

  公开（公告）日：2018-04-17