1,3-dicyclohexyl-O-(N-cyclohexylideneamino)-isourea | 1254204-60-8

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 甲亚胺酸及其衍生物
• 英文名称: 1,3-dicyclohexyl-O-(N-cyclohexylideneamino)-isourea
• 英文别名: 1,3-Dicyclohexyl-O-(N-cyclohexylideneamino)-isourea；(cyclohexylideneamino) N,N'-dicyclohexylcarbamimidate
• CAS: 1254204-60-8
• 化学式: C₁₉H₃₃N₃O
• 分子量: 319.491
• InChiKey: VSMRPKQQWDXXQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  46
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  环己酮肟 、 N,N'-二环己基碳二亚胺 在 sodium hydroxide 作用下， 以 四氢呋喃 为溶剂， 反应 5.0h， 生成 1,3-dicyclohexyl-O-(N-cyclohexylideneamino)-isourea
  参考文献：
  名称：

  [EN] O-IMINO-ISO-UREA COMPOUNDS AND POLYMERIZABLE COMPOSITIONS THEREOF
  [FR] COMPOSÉS DE O-IMINO-ISO-URÉE ET LEURS COMPOSITIONS POLYMÉRISABLES

  摘要：

  该发明涉及将O-亚亚胺基-异脲化合物用作自由基的来源，用于包括这些O-亚亚胺基-异脲化合物的聚合物组合物，以及新的O-亚亚胺基-异脲化合物。O-亚亚胺基-异脲化合物是具有以下式（I）的化合物，其中n为1、2、3或4，R100和R101独立地为H、C1-18烷基、C3-C12环烷基、C6-C14芳基、C1-C14杂芳基、C7-C15芳基烷基、C2-C14杂芳基烷基、氰基，或R100和R101与它们连接的碳共同形成一个单环或多环的C3-C18碳环或C1-C18杂环；R102和R103独立地为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C6-C14芳基，或被C1-C18烷基取代一次或多次，C7-C15芳基烷基，（CH3）3Si-；或者R102和R103为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C7-C15芳基烷基，或者R102和R103为被O或N含基团中断或取代的C1-C18烷基胺基、双（C1-C18烷基）胺基或三（C1-C1talkyl）铵；如果n为1，则R104为H、C1-C18烷基、C3-C12环烷基、C7-C14芳基烷基、C6-C14芳基或从以下酰基中选择的酰基 -C（=O）-H、-C（=O）-C1-C18烷基、-C（=O）-C2-d18烯基、-C（=O）-C6-C14芳基、-C（=O）-C2-C18烯基-C6-C14芳基、-C（=O）-O-C1C18烷基、-C（=O）-O-C6-C14芳基、-C（=O）-NH-C1-C18烷基、-C（=O）-NH-C6-C14芳基和-C（=O）-N（C1C18烷基）2；或者如果n为1，则R102和R104共同与它们连接的氮原子形成一个含有额外杂原子的5至12元环；如果n大于1，则R104为二、三、四个C1-C18烷基亚甲基、二酰基、三酰基或四酰基及其盐。

  公开号：

  WO2010128062A1

文献信息

• 이중 경화가 가능한 저온가교형 블록이소시아네이트 및 이를 포함하는 조성물
  申请人：KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY 한국화학연구원(319980077651)

  公开号：KR20180108307A

  公开（公告）日：2018-10-04

  본원 발명은 해리온도가 서로 다른 이중경화 반응형 구조의 새로운 블록이소시아네이트에 대한 것으로, 보다 구체적으로는 지방족, 방향족,지환식(alicyclic), 또는 방향지방족 디이소시아네이트인 폴리이소시아네이트 화합물의 이소시아네이트기를 라디칼 개시제로 블록화하여 제조되는 이중 경화가 가능한 저온가교형 블록이소시아네이트 및 이러한 블록이소시아네이트와 에틸렌계 또는 아크릴계의 불포화 이중결합과 수산화기를 동시에 가지는 단량체 또는 올리고머를 포함하는 저온가교형 조성물에 대한 것이다. 본원 발명에 따른 블록이소시아네이트는 저온에서 해리가 가능한 블록킹 그룹이 해리되면서 표면 및 계면에서의 경화반응을 먼저 형성하여 빠른 작업이 가능하며 그 후 내부에서의 가교는 온도가 올라가면서 디블록된 프리-이소시아네이트가 진행하게 되므로 공정차원에서의 표면경화가 빨리 일어나야 하는 코팅 및 도료, 접착기술에서의 활용성이 매우 높은 장점이 있다.

  该专利发明涉及一种具有不同硬度的双重交联反应结构的新型块状异氰酸酯，更具体地说，它是通过将脂肪族、芳香族、脂环族或芳香脂环族二异氰酸酯的异氰酸酯基作为自由基引发剂块化制备的低温交联型块状异氰酸酯及包含这些块状异氰酸酯和同时具有乙烯基或丙烯酸基不饱和双键和羟基的单体或聚合物的低温交联型组合物。根据本专利发明，块状异氰酸酯在低温下可以完成交联，当阻塞基团在低温下被解除时，它首先在表面和界面上形成固化反应，因此可以快速操作。而在温度升高时，内部交联是由双异氰酸酯自由基进行的，因此在涂料、涂料和粘合技术中需要快速表面固化的工艺中具有很高的应用性。
• O-IMINO-ISO-UREA COMPOUNDS AND POLYMERIZABLE COMPOSITIONS THEREOF
  申请人：Nesvadba Peter

  公开号：US20120108696A1

  公开（公告）日：2012-05-03

  The invention relates to the use of O-imino-iso-urea compounds as source of radicals to polymerizable compositions comprising these O-imino-iso-urea and to new O-imino-iso-urea compounds. The O-lmino-isoureas compounds are compounds of the Formula (I), wherein n is 1, 2, 3 or 4, R 100 and R 101 are independently H, C 1-18 alkyl, C 3 -C 12 cycloalkyl, C 6 -C 14 aryl, C 1 -C 14 heteroaryl, C 7 -C 15 aralkyl, C 2 -C 14 heteroaralkyl, Cyano, or R 100 and R 101 form together with the carbon to which they are attached a mono or polycyclic C 3 -C 18 carbocyclic or C 1 -C 18 heterocyclic ring; R 102 and R 103 are independently C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl, C 6 -C 14 aryl, C 6 -C 14 aryl once or more than once substituted by C 1 -C 18 alkyl; C 7 -C 15 aralkyl, (CH 3 ) 3 Si—; or R 102 and R 103 are C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl, C 6 -C 14 aryl, C 7 -C 15 aralkyl or R 102 and R 103 are C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl which are interrupted or substituted by O or by N containing groups selected from C 1 -C 18 alkylamino, bis(C 1 -C 18 alkyl)amino or tris(C 1 -C 18 alkyl)ammonium; R 104 if n is 1 is H, C 1 -C 18 alkyl, C 3 -C 12 cycloalkyl, C 7 -C 14 aralkyl, C 6 -C 14 aryl or acyl selected from the group consisting of the following acyls —C(═O)—H, —C(═O)—C 1 -C 18 alkyl, —C(═O)—C 2 -d 18 alkenyl, —C(═O)—C 6 -C 14 aryl, —C(═O)—C 2 -C 18 alkenyl-C 6 -C 14 aryl, —C(═O)—O—C 1 C 18 alkyl, —C(═O)—O—C 6 -C 14 aryl, —C(═O)—NH—C 1 -C 18 alkyl, —C(═O)—NH—C 6 -C 14 aryl and —C(═O)—N(C 1 C 18 alkyl) 2 ; or R 102 and R 104 if n is 1 form together with the nitrogen atom to which they are attached a 5 to 12 membered ring which may contain additional heteroatoms, R 104 if n is more than 1 is di-, tri-, tetra-C 1 -C 18 alkylidene, diacyls, triacyls or tetraacyls and salts thereof.

  本发明涉及将O-亚胺异脲化合物用作自由基的来源，所述自由基可用于包含这些O-亚胺异脲化合物的可聚合组合物，并涉及新的O-亚胺异脲化合物。O-亚胺异脲化合物是化合物(I)的化合物，其中n为1、2、3或4，R100和R101独立地为H、C1-18烷基、C3-C12环烷基、C6-C14芳基、C1-C14杂芳基、C7-C15芳基烷基、C2-C14杂芳基、氰基，或R100和R101与它们所连接的碳共同形成一个单环或多环的C3-C18碳环烷基或C1-C18杂环烷基；R102和R103独立地为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C6-C14芳基经过一次或多次取代的C1-C18烷基；C7-C15芳基烷基、(CH3)3Si—；或R102和R103为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C7-C15芳基烷基，或者R102和R103为C1-C18烷基、C3-C12环烷基，其中通过O或N含有的C1-C18烷基氨基、双(C1-C18烷基)氨基或三(C1-C18烷基)铵基中断或取代；如果n为1，则R104为H、C1-C18烷基、C3-C12环烷基、C7-C14芳基烷基、C6-C14芳基或从以下酰基中选择的酰基，所述酰基包括以下酰基：—C(═O)—H、—C(═O)—C1-C18烷基、—C(═O)—C2-d18烯基、—C(═O)—C6-C14芳基、—C(═O)—C2-C18烯基-C6-C14芳基、—C(═O)—O—C1C18烷基、—C(═O)—O—C6-C14芳基、—C(═O)—NH—C1-C18烷基、—C(═O)—NH—C6-C14芳基和—C(═O)—N(C1C18烷基)2；或者如果n为1，则R102和R104与它们所连接的氮原子共同形成一个5到12个成员的环，该环可以含有额外的杂原子；如果n大于1，则R104为二、三、四个C1-C18烷基亚甲基，二酰基、三酰基或四酰基及其盐。
• O-imino-iso-urea compounds and polymerizable compositions thereof
  申请人：Nesvadba Peter

  公开号：US08664288B2

  公开（公告）日：2014-03-04

  The invention relates to the use of O-imino-iso-urea compounds as source of radicals to polymerizable compositions comprising these O-imino-iso-urea and to new O-imino-iso-urea compounds. The O-lmino-isoureas compounds are compounds of the Formula (I), wherein n is 1, 2, 3 or 4, R100 and R101 are independently H, C1-18 alkyl, C3-C12cycloalkyl, C6-C14aryl, C1-C14heteroaryl, C7-C15aralkyl, C2-C14heteroaralkyl, Cyano, or R100 and R101 form together with the carbon to which they are attached a mono or polycyclic C3-C18 carbocyclic or C1-C18 heterocyclic ring; R102 and R103 are independently C1-C18alkyl, C3-C12cycloalkyl, C6-C14aryl, C6-C14aryl once or more than once substituted by C1-C18alkyl; C7-C15aralkyl, (CH3)3Si—; or R102 and R103 are C1-C18alkyl, C3-C12cycloalkyl, C6-C14aryl, C7-C15aralkyl or R102 and R103 are C1-C18alkyl, C3-C12cycloalkyl which are interrupted or substituted by O or by N containing groups selected from C1-C18alkylamino, bis(C1-C18alkyl)amino or tris(C1-C18alkyl)ammonium; R104 if n is 1 is H, C1-C18alkyl, C3-C12cycloalkyl, C7-C14aralkyl, C6-C14aryl or acyl selected from the group consisting of the following acyls —C(═O)—H, —C(═O)—C1-C18alkyl, —C(═O)—C2-d18alkenyl, —C(═O)—C6-C14aryl, —C(═O)—C2-C18alkenyl-C6-C14aryl, —C(═O)—O—C1C18alkyl, —C(═O)—O—C6-C14aryl, —C(═O)—NH—C1-C18alkyl, —C(═O)—NH—C6-C14aryl and —C(═O)—N(C1C18alkyl)2; or R102 and R104 if n is 1 form together with the nitrogen atom to which they are attached a 5 to 12 membered ring which may contain additional heteroatoms, R104 if n is more than 1 is di-, tri-, tetra-C1-C18alkylidene, diacyls, triacyls or tetraacyls and salts thereof.

  本发明涉及将O-亚氨基异脲化合物用作自由基的来源，用于包含这些O-亚氨基异脲和新的O-亚氨基异脲化合物的聚合物组合物中。O-亚氨基异脲化合物是式（I）的化合物，其中n为1、2、3或4，R100和R101分别为H、C1-18烷基、C3-C12环烷基、C6-C14芳基、C1-C14杂芳基、C7-C15芳基烷基、C2-C14杂芳基烷基、氰基，或者R100和R101与它们连接的碳一起形成一个单环或多环的C3-C18碳环或C1-C18杂环；R102和R103分别为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C6-C14芳基一次或多次被C1-C18烷基取代、C7-C15芳基烷基、(CH3)3Si-；或者R102和R103为C1-C18烷基、C3-C12环烷基、C6-C14芳基、C7-C15芳基烷基，或者R102和R103为C1-C18烷基、C3-C12环烷基，其中被O或N含有基团所取代或打断，所述基团选择自C1-C18烷基氨基、双(C1-C18烷基)氨基或三(C1-C18烷基)铵；如果n为1，则R104为H、C1-C18烷基、C3-C12环烷基、C7-C14芳基烷基、C6-C14芳基或酰基，所述酰基选择自以下酰基：—C(═O)—H、—C(═O)—C1-C18烷基、—C(═O)—C2-d18烯基、—C(═O)—C6-C14芳基、—C(═O)—C2-C18烯基-C6-C14芳基、—C(═O)—O—C1C18烷基、—C(═O)—O—C6-C14芳基、—C(═O)—NH—C1-C18烷基、—C(═O)—NH—C6-C14芳基和—C(═O)—N(C1C18烷基)2；或者如果n为1，则R102和R104与它们连接的氮原子一起形成一个5到12个成员的环，该环可以包含其他杂原子；如果n大于1，则R104为二元、三元、四元C1-C18烷基亚烷基、二酰基、三酰基或四酰基及其盐。
• POLYMERIZABLE COMPOSITIONS AND OPTICAL ARTICLES PREPARED THEREFROM
  申请人：PPG INDUSTRIES OHIO, INC.

  公开号：US20140128534A1

  公开（公告）日：2014-05-08

  Provided is a polymerizable non-aqueous dispersion, wherein the non-aqueous dispersion comprises: (a) a polymerizable component; and (b) polymeric microparticles dispersed in a continuous phase, wherein the microparticles comprise a dispersion polymerization reaction product prepared from a reaction mixture comprising an ethylenically unsaturated monomer, and an acrylic polymer stabilizer, and wherein the continuous phase is the same as or different from the polymerizable component (a). Also provided are optical articles prepared from the polymerizable non-aqueous dispersions.

  提供的是一种可聚合的非水分散体系，其中该非水分散体系包括：（a）可聚合组分；以及（b）分散在连续相中的聚合微粒，其中微粒包括从反应混合物中制备的分散聚合反应产物，该反应混合物包括乙烯基不饱和单体和丙烯酸聚合物稳定剂，连续相与可聚合组分（a）相同或不同。还提供了从该可聚合的非水分散体系制备的光学制品。
• POLYMERIZABLE COMPOSITIONS CONTAINING (METH)ACRYLATE MONOMERS HAVING SULFIDE LINKAGES
  申请人：PPG Industries Ohio, Inc.

  公开号：EP3838935A2

  公开（公告）日：2021-06-23

  Provided is a polymerizable composition including (meth)acrylate monomers having at least two sulfide (-S-) linkages in the monomer. The polymerizable compositions include a first (meth)acrylate monomer represented by the following Formula (I), where L1 is selected from a multivalent optionally substituted hydrocarbyl group optionally interrupted with at least one of -C(O)-, -S-, -O- and combinations thereof, and a divalent linking group represented by the following Formula (A). In Formula (A), Y is O or S. Also in Formula (I), L2 is independently for each n a divalent optionally substituted hydrocarbyl group optionally interrupted with at least one of -O- and -S-, R1 is independently selected for each n from hydrogen and methyl, and n is from 2 to 6. The polymerizable compositions also may include a polymerization moderator. Also provided are polymerizates including photochromic articles and optical elements prepared from such polymerizable compositions.

  本发明提供了一种可聚合组合物，包括在单体中具有至少两个硫化物（-S-）连接的（甲基）丙烯酸酯单体。可聚合组合物包括由下式（I）代表的第一种（甲基）丙烯酸酯单体、 其中 L1 选自至少用-C(O)-、-S-、-O-及其组合中的一种任选间断的多价任选取代的烃基，以及由下式(A)表示的二价连接基团。 在式 (A) 中，Y 是 O 或 S。同样在式 (I) 中，L2 对于每个 n 独立地是二价任选取代的烃基，任选被 -O- 和 -S- 中的至少一种打断，R1 对于每个 n 独立地选自氢和甲基，n 是 2 到 6。可聚合组合物还可包括聚合调节剂。此外，还提供了聚合物，包括光致变色物品和由此类可聚合组合物制备的光学元件。