N-Ethoxythiocarbonyloxy-Δ⁴-tetrahydrophthalimid | 103797-27-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异吲哚及其衍生物
• 英文名称: N-Ethoxythiocarbonyloxy-Δ⁴-tetrahydrophthalimid
• 英文别名: 2-Ethoxycarbothioyloxy-3a,4,7,7a-tetrahydroisoindole-1,3-dione
• CAS: 103797-27-9
• 化学式: C₁₁H₁₃NO₄S
• 分子量: 255.295
• InChiKey: PWBCYPSSMYCPQG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  87.9
• 氢给体数：
  0
• 氢受体数：
  5

文献信息

• N-Substituted Imides As Polymerization Initiators
  申请人：Nesvadba Peter

  公开号：US20080132600A1

  公开（公告）日：2008-06-05

  The invention relates to novel N-substituted imides and polymerizable compositions comprising these N-substituted imides. The invention further relates to the use of N-substituted imides as polymerization initiators. The imides are compounds of the formula (I) and (II) wherein n is 1 or 2; m is 1 or 2; R 1 and R 2 are each, independently of one another, hydrogen, C 1 -C 18 alkyl, C 1 -C 18 alkenyl C 6 -C 14 aryl, aralkyl, C 5 -C 12 cycloalkyl, each of which may be substituted by halogen, C 1 -C 4 -alkyl, hydroxy, C 1 -C 6 alkoxy, carbonyl, C 1 -C 6 alkoxycarbonyl; or R 1 and R 2 together with the adjacent —CO—N—CO— group may form a monocyclic, bicyclic or polycyclic ring, said ring having up to 50 non hydrogen atoms and wherein said ring may contain the structural element (formula III) more than once; R 3 if n is 1, is C 1 -C 18 alkyl, C 6 -C 14 aryl, aralkyl, C 5 -C 12 cycloalkyl, OR 10 or SR 11 , NR 12 R 13 ; wherein R 3 if n is 2, is C 2 -C 12 alkylene, C 6 -C 14 arylene, xylylene R 4 and R 5 , correspond to R 1 and R 2 ; R 6 if n is 1, is hydrogen, C 1 -C 18 alkyl, C 6 -C 14 aryl, aralkyl, C 5 -C 12 cycloalkyl, NR 14 R 15 ; wherein R 6 if n is 2, is C 2 -C 12 alkylene, C 6 -C 14 arylene, xylylene; R 7 is hydrogen, C 1 -C 18 alkyl, C 6 -C 14 aryl, aralkyl, C 5 -C 12 cycloalkyl, each of which may be substituted by halogen, C 1 -C 4 -alkyl, hydroxy, C 1 -C 6 alkoxy, carbonyl, C 1 -C 6 alkoxy-carbonyl; or R 7 and R 14 or R 7 and R 15 form together with the N-atom attached to R 7 a 5-6 membered ring, optionally interrupted by —NH—, —N(C 1 -C 8 alkyl)-, —O- and/or S-atoms.

  本发明涉及新型N-取代酰亚胺和包含这些N-取代酰亚胺的可聚合组合物。本发明还涉及将N-取代酰亚胺用作聚合引发剂。该酰亚胺是具有以下结构式(I)和(II)的化合物，其中n为1或2；m为1或2；R1和R2各自独立地为氢、C1-C18烷基、C1-C18烯基、C6-C14芳基、芳基烷基、C5-C12环烷基，这些基团均可被卤素、C1-C4烷基、羟基、C1-C6烷氧基、羰基、C1-C6烷氧羰基取代；或者R1和R2与相邻的—CO—N—CO—基团一起形成单环、双环或多环环，该环具有高达50个非氢原子，且该环可能包含结构元素(式III)超过一次；如果n为1，则R3为C1-C18烷基、C6-C14芳基、芳基烷基、C5-C12环烷基、OR10或SR11、NR12R13；如果n为2，则R3为C2-C12烷基、C6-C14芳基、二甲苯基，R4和R5与R1和R2对应；如果n为1，则R6为氢、C1-C18烷基、C6-C14芳基、芳基烷基、C5-C12环烷基、NR14R15；如果n为2，则R6为C2-C12烷基、C6-C14芳基、二甲苯基；R7为氢、C1-C18烷基、C6-C14芳基、芳基烷基、C5-C12环烷基，这些基团均可被卤素、C1-C4烷基、羟基、C1-C6烷氧基、羰基、C1-C6烷氧羰基取代；或者R7和R14或R7和R15一起形成与连接到R7的N原子相连的5-6成员环，该环可以由—NH—、—N(C1-C8烷基)-、—O-和/或S原子中断。
• US7723399B2
  申请人：——

  公开号：US7723399B2

  公开（公告）日：2010-05-25