N-[[4,6-bis[(cyclohexylideneamino)oxy]-1,3,5-triazin-2-yl]oxy]cyclohexanimine | 7050-72-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 三嗪类
• 英文名称: N-[[4,6-bis[(cyclohexylideneamino)oxy]-1,3,5-triazin-2-yl]oxy]cyclohexanimine
• 英文别名: s-Triazin-tris-(O-cyclohexanonoxim)；tris-cyclohexylideneaminooxy-[1,3,5]triazine；2,4,6-tris(cyclohexylidene-aminooxy)-1,3,5-triazine
• CAS: 7050-72-8
• 化学式: C₂₁H₃₀N₆O₃
• 分子量: 414.508
• InChiKey: UEWYWWKEGLOACU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  30
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  103
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  环己酮肟 、 三聚氯氰 在 吡啶 作用下， 反应 15.0h， 以3.57 g的产率得到N-[[4,6-bis[(cyclohexylideneamino)oxy]-1,3,5-triazin-2-yl]oxy]cyclohexanimine
  参考文献：
  名称：

  [EN] IMINOXYTRIAZINES AS RADICAL GENERATORS
  [FR] IMINOXYTRIAZINES À TITRE DE GÉNÉRATEURS DE RADICAUX

  摘要：

  Iminoxytriazine化合物的结构式（I），其中n为1或2；R1和R2彼此独立地为氢、NH2、NHR5、NR5R6、COR5、COOR5、CONH2、CONHR5、CONR5R6、CN、SR5、OR5、C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基，其中所述的C3-C12环烷基、C6-C14芳基或C2-C14杂芳基未取代或通过来自C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基的一个或多个基团取代，或者R1和R2与它们连接的C原子一起形成未取代或通过来自C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基的一个或多个基团取代的4到12元碳环或杂环饱和或不饱和环，R3为F、Cl、OH、OR、SH、SR5、NH2、NHR5、NR5R6或R1R2C=N-O-；其中在结构式I的化合物中所有R1R2C=N-O-中的R1和R2相同或不同；如果n为1，R4为F、Cl、OH、OR5、SH、SR5、NH2、NHR5、NR5R6或R1R2C=N-O-；其中在结构式I的化合物中所有R1R2C=N-O-中的R1和R2相同或不同；如果n为2，R4为源自二醇、双胺、氨基醇或巯基醇的双官能团；R5和R6彼此独立地为C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基；适用作基团生成剂。

  公开号：

  WO2014064064A1

文献信息

• PROCESS FOR PRODUCTION OF AMIDES OR LACTAMS
  申请人：Daicel Chemical Industries, Ltd.

  公开号：EP2006283A9

  公开（公告）日：2009-07-15

  An amide or lactam is produced by conducting a rearrangement of a corresponding oxime compound in the presence of a cyclic compound containing a structure represented by following Formula (1) as a ring constituent and a fluorinated alcohol: wherein Z represents a halogen atom or an -OR group, where R represents an organic group. Z is preferably chlorine atom. Exemplary fluorinated alcohols include fluorine-containing branched-chain aliphatic alcohols represented by following Formula (3): wherein Rf1 and Rf2 may be the same as or different from each other and each represent a perfluoroalkyl group having one to eight carbon atoms; and "n" denotes an integer of 0 to 8. According to this process, amides or lactams can be simply produced in high yields without causing large amounts of by-products.

  通过在含有以下式（1）所代表的结构的环组分和氟化醇的存在下对相应的肟化合物进行重排，可以产生酰胺或内酰胺：其中Z代表卤素原子或-OR基团，其中R代表有机基团。Z最好是氯原子。示例氟化醇包括以下式（3）所代表的含氟支链脂肪醇：其中Rf1和Rf2可以相同也可以不同，每个代表具有一至八个碳原子的全氟烷基基团；“n”表示0至8的整数。根据这个过程，可以简单地高产率地生产酰胺或内酰胺，而不产生大量副产物。
• Iminoxytriazines as radical generators
  申请人：BASF SE

  公开号：US09255217B2

  公开（公告）日：2016-02-09

  Iminoxytriazine compounds of the formula I wherein n is 1 or 2; R1 and R2 independently of each other are hydrogen, NH2, NHR5, NR5R6, COR5, COOR5, CONH2, CONHR5, CONR5R6, CN, SR5, OR5, C1-C18alkyl, C3-C12cycloalkyl, C6-C14aryl or C2-C14heteroaryl, wherein said C3-C12cycloalkyl, C6-C14aryl or C2-C14heteroaryl is unsubstituted or substituted by one or more radicals selected from the group consisting of C1-C12alkyl, C3-C12-cycloalkyl, phenyl, halogen and C1-C12 alkoxy, or R1 and R2 together with the C atom to which they are linked form a 4 to 12 membered carbocyclic or heterocyclic saturated or unsaturated ring which is unsubstituted or substituted by one or more radicals selected from the group consisting of C1-C12alkyl, C3-C12-cycloalkyl, phenyl, halogen and C1-C12 alkoxy; R3 is F, Cl, OH, OR5, SH, SR5, NH2, NHR5, NR5R6 or R1R2C═N—O—; wherein R1 and R2 in all groups R1R2C═N—O— in the compound of the formula I are identical or different; if n is 1, R4 is F, Cl, OH, OR5, SH, SR5, NH2, NHR5, NR5R6 or R1R2C═N—O—; wherein R1 and R2 in all groups R1R2C═N—O— in the compound of the formula I are identical or different; if n is 2, R4 is a difunctional group derived from a diol, diamine, aminoalcohol or mercaptoalcohol; R5 and R6 independently of each other are C1-C18alkyl, C3-C12cycloalkyl, C6-C14aryl or C2-C14heteroaryl; are suitable as radical generating agents.

  化合物I的亚氨基三嗪化合物，其中n为1或2；R1和R2独立地为氢、NH2、NHR5、NR5R6、COR5、COOR5、CONH2、CONHR5、CONR5R6、CN、SR5、OR5、C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基，其中所述的C3-C12环烷基、C6-C14芳基或C2-C14杂芳基未被取代或被一个或多个从C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基中选择的基团所取代；或者R1和R2与它们连接的碳原子一起形成一个4到12成员的碳环或杂环，该碳环或杂环未被取代或被一个或多个从C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基中选择的基团所取代；R3为F、Cl、OH、OR5、SH、SR5、NH2、NHR5、NR5R6或R1R2C═N—O—；其中在化合物I的所有R1R2C═N—O—基团中，R1和R2相同或不同；如果n为1，则R4为F、Cl、OH、OR5、SH、SR5、NH2、NHR5、NR5R6或R1R2C═N—O—；其中在化合物I的所有R1R2C═N—O—基团中，R1和R2相同或不同；如果n为2，则R4为从二元醇、二胺、氨基醇或巯基醇衍生的二功能基团；R5和R6独立地为C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基；适用于生成自由基的剂。
• IMINOXYTRIAZINES AS RADICAL GENERATORS
  申请人：BASF SE

  公开号：US20150284604A1

  公开（公告）日：2015-10-08

  Iminoxytriazine compounds of the formula I wherein n is 1 or 2; R 1 and R 2 independently of each other are hydrogen, NH 2 , NHR 5 , NR 5 R 6 , COR 5 , COOR 5 , CONH 2 , CONHR 5 , CONR 5 R 6 , CN, SR 5 , OR 5 , C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl, C 6 -C 14 aryl or C 2 -C 14 heteroaryl, wherein said C 3 -C 12 cycloalkyl, C 6 -C 14 aryl or C 2 -C 14 heteroaryl is unsubstituted or substituted by one or more radicals selected from the group consisting of C 1 -C 12 alkyl, C 3 -C 12 -cycloalkyl, phenyl, halogen and C 1 -C 12 alkoxy, or R 1 and R 2 together with the C atom to which they are linked form a 4 to 12 membered carbocyclic or heterocyclic saturated or unsaturated ring which is unsubstituted or substituted by one or more radicals selected from the group consisting of C 1 -C 12 alkyl, C 3 -C 12 -cycloalkyl, phenyl, halogen and C 1 -C 12 alkoxy; R 3 is F, Cl, OH, OR 5 , SH, SR 5 , NH 2 , NHR 5 , NR 5 R 6 or R 1 R 2 C═N—O—; wherein R 1 and R 2 in all groups R 1 R 2 C═N—O— in the compound of the formula I are identical or different; if n is 1, R 4 is F, Cl, OH, OR 5 , SH, SR 5 , NH 2 , NHR 5 , NR 5 R 6 or R 1 R 2 C═N—O—; wherein R 1 and R 2 in all groups R 1 R 2 C═N—O— in the compound of the formula I are identical or different; if n is 2, R 4 is a difunctional group derived from a diol, diamine, aminoalcohol or mercaptoalcohol; R 5 and R 6 independently of each other are C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl, C 6 -C 14 aryl or C 2 -C 14 heteroaryl; are suitable as radical generating agents.

  公式I中的亚硝基三嗪化合物，其中n为1或2；R1和R2独立地为氢、NH2、NHR5、NR5R6、COR5、COOR5、CONH2、CONHR5、CONR5R6、CN、SR5、OR5、C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基，其中所述的C3-C12环烷基、C6-C14芳基或C2-C14杂芳基未取代或取代为来自C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基的一个或多个基团；或者R1和R2与它们连接的C原子一起形成一个4到12个成员的碳环或杂环，该碳环或杂环未取代或取代为来自C1-C12烷基、C3-C12环烷基、苯基、卤素和C1-C12烷氧基的一个或多个基团；R3为F、Cl、OH、OR5、SH、SR5、NH2、NHR5、NR5R6或R1R2C═N—O—；其中在公式I中的所有R1R2C═N—O—基团中，R1和R2相同或不同；如果n为1，则R4为F、Cl、OH、OR5、SH、SR5、NH2、NHR5、NR5R6或R1R2C═N—O—；其中在公式I中的所有R1R2C═N—O—基团中，R1和R2相同或不同；如果n为2，则R4为来自二元醇、二胺、氨基醇或巯基醇的二官能团；R5和R6独立地为C1-C18烷基、C3-C12环烷基、C6-C14芳基或C2-C14杂芳基；适用于产生基团的生成剂。
• PRODUCTION METHOD AND BECKMANN REARRANGEMENT CATALYST FOR PRODUCING A CYCLIC LACTAM COMPOUND
  申请人：National University Corporation Nagoya University

  公开号：EP2241552B1

  公开（公告）日：2018-11-14
• Process for Production of Amides or Lactams
  申请人：Ishii Yasutaka

  公开号：US20090093628A1

  公开（公告）日：2009-04-09

  An amide or lactam is produced by conducting a rearrangement of a corresponding oxime compound in the presence of a cyclic compound containing a structure represented by following Formula (1) as a ring constituent and a fluorinated alcohol: wherein Z represents a halogen atom or an —OR group, where R represents an organic group. Z is preferably chlorine atom. Exemplary fluorinated alcohols include fluorine-containing branched-chain aliphatic alcohols represented by following Formula (3): wherein Rf 1 and Rf 2 may be the same as or different from each other and each represent a perfluoroalkyl group having one to eight carbon atoms; and “n” denotes an integer of 0 to 8. According to this process, amides or lactams can be simply produced in high yields without causing large amounts of by-products.