2-((dicyclohexylphosphino)methyl)pyridine | 959042-89-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 2-((dicyclohexylphosphino)methyl)pyridine
• 英文别名: 2-[(dicyclohexylphosphino)methyl]pyridine；Pyridine, 2-dicyclohexylphosphinomethyl-；dicyclohexyl(pyridin-2-ylmethyl)phosphane
• CAS: 959042-89-8
• 化学式: C₁₈H₂₈NP
• 分子量: 289.401
• InChiKey: OIUYBSGTWOYPQA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.72
• 拓扑面积：
  12.9
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  copper(l) iodide 、 2-((dicyclohexylphosphino)methyl)pyridine 以 二氯甲烷 、 乙腈 为溶剂， 以31%的产率得到Cu4I4(2-[(dicyclohexylphosphino)methyl]pyridine)2
  参考文献：
  名称：

  Cu₄I₄ Clusters Supported by P^∧N-type Ligands: New Structures with Tunable Emission Colors

  摘要：

  A series of Cu4I4 clusters (1-5) supported by two (PN)-N-boolean AND-type ligands 2-[(diRphosphino)methyl]pyridine (1, R = phenyl; 2, R = cyclohexyl; 3, R = tert-butyl; 4, R = iso-propyl; 5, R = ethyl) have been synthesized. Single crystal X-ray analyses show that all five clusters adopt a rare "octahedral" geometry. The central core of the cluster consists of the copper atoms arranged in a parallelogram with mu(4)-iodides above and below the copper plane. The copper atoms on the two short edges of the parallelogram (Cu-Cu = 2.525(2)-2.630(1) angstrom) are bridged with mu(2)-iodides, whereas the long edges (Cu-Cu = 2.839(3)-3.035(2) angstrom) are bridged in an antiparallel fashion by the (PN)-N-boolean AND ligands. This Cu4I4 geometry differs significantly from the "cubane" and "stairstep" geometries reported for other Cu4I4L4 clusters. Luminescence spectra of clusters 3 and 4 display a single emission around 460 nm at room temperature that is assigned to emission from a triplet halide-to-ligand charge-transfer ((XLCT)-X-3) excited state, whereas clusters 1, 2, and 5 also have a second band around 570 nm that is assigned to a Cu4I4 cluster-centered ((CC)-C-3) excited state. The structural and photophysical properties of a dinuclear Cu2I2((PN)-N-boolean AND)(2) complex obtained during the sublimation of cluster 3 is also provided.

  DOI：

  10.1021/ic2015226
• 作为产物：
  描述：

  二环己基氯化膦 在 吗啉 、 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 反应 12.5h， 生成 2-((dicyclohexylphosphino)methyl)pyridine
  参考文献：
  名称：

  Catalytic hydrogenation of unactivated amides enabled by hydrogenation of catalyst precursor

  摘要：

  A general method for catalytic hydrogenation of unactivated amides was achieved. During the catalyst induction period, a novel structural change was observed involving full hydrogenation of the interior unsaturated bonds of the pyridines of the Ru-containing catalyst precursor. Based on this observation, the mechanism of amide hydrogenation may involve a two-step pathway, wherein the Ru catalyst having an H-Ru-N-H functionality is generated in the first step, followed by the amide carbonyl group interacting with the outer, rather than the inner, sphere of the Ru catalyst. (c) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.03.047

文献信息

• Cobalt compound useful as catalyst for hydrosilylation, dehydrogenative silylation and crosslinking of silicone compositions
  申请人：ELKEM SILICONES FRANCE SAS

  公开号：US11027267B2

  公开（公告）日：2021-06-08

  The subject of the present invention is the use, as hydrosilylation and/or dehydrogenative silylation catalyst, of a cobalt compound of formula (1): [CO(N(SiR3)2)x]y in which: —the R symbols, which are identical or different, represent a hydrogen atom or a hydrocarbon-based radical having from 1 to 12 carbon atoms, and preferably the R symbols, which are identical or different, are chosen from the group consisting of: a hydrogen atom, alkyl groups having from 1 to 8 carbon atoms and aryl groups having from 6 to 12 carbon atoms, —x=1, 2 or 3 and—y=1 or 2.

  本发明的主题是使用式 (1) 的钴化合物作为氢化硅烷化和/或脱氢硅烷化催化剂：[CO(N(SiR3)2)x]y，其中-相同或不同的 R 符号代表氢原子或具有 1 至 12 个碳原子的烃基，优选的是，相同或不同的 R 符号选自由氢原子、具有 1 至 8 个碳原子的烷基和具有 6 至 12 个碳原子的芳基组成的组，-x=1、2 或 3，y=1 或 2。
• COMPOSE DU COBALT UTILE COMME CATALYSEUR D'HYDROSILYLATION, DE SILYLATION DESHYDROGENANTE ET DE RETICULATION DE COMPOSITIONS SILICONES
  申请人：ELKEM SILICONES France SAS

  公开号：EP3559088B1

  公开（公告）日：2020-11-18
• COBALT COMPOUND USEFUL AS CATALYST FOR HYDROSILYLATION, DEHYDROGENATIVE SILYLATION AND CROSSLINKING OF SILICONE COMPOSITIONS
  申请人：ELKEM SILICONES FRANCE SAS

  公开号：US20190329231A1

  公开（公告）日：2019-10-31

  The subject of the present invention is the use, as hydrosilylation and/or dehydrogenative silylation catalyst, of a cobalt compound of formula (1): [CO(N(SiR 3 ) 2 ) x ] y in which: —the R symbols, which are identical or different, represent a hydrogen atom or a hydrocarbon-based radical having from 1 to 12 carbon atoms, and preferably the R symbols, which are identical or different, are chosen from the group consisting of: a hydrogen atom, alkyl groups having from 1 to 8 carbon atoms and aryl groups having from 6 to 12 carbon atoms, —x=1, 2 or 3 and—y=1 or 2.
• [EN] COBALT COMPOUND USEFUL AS CATALYST FOR HYDROSILYLATION, DEHYDROGENATIVE SILYLATION AND CROSSLINKING OF SILICONE COMPOSITIONS<br/>[FR] COMPOSE DU COBALT UTILE COMME CATALYSEUR D'HYDROSILYLATION, DE SILYLATION DESHYDROGENANTE ET DE RETICULATION DE COMPOSITIONS SILICONES
  申请人：ELKEM SILICONES FRANCE SAS

  公开号：WO2018115601A1

  公开（公告）日：2018-06-28

  La présente invention a pour objet l'utilisation en tant que catalyseur d'hydrosilylation et/ou de silylation déshydrogénante d'un composé du cobalt de formule (1): [CO(N(SiR3)2)x]y dans laquelle: - les symboles R, identiques ou différents, représentent un atome d'hydrogène ou un radical hydrocarboné ayant de 1 à 12 atomes de carbone, et de préférence les symboles R, identiques ou différents, sont choisis dans le groupe constitué par; l'atome d'hydrogène, les groupes alkyles ayant de 1 à 8 atomes de carbone et les groupes aryles ayant de 6 à 12 atomes de carbone, - x-1, 2 ou 3 et - y=1 ou 2.
• Catalytic hydrogenation of unactivated amides enabled by hydrogenation of catalyst precursor
  作者：Takashi Miura、Ingmar E. Held、Shunsuke Oishi、Masayuki Naruto、Susumu Saito

  DOI：10.1016/j.tetlet.2013.03.047

  日期：2013.5

  A general method for catalytic hydrogenation of unactivated amides was achieved. During the catalyst induction period, a novel structural change was observed involving full hydrogenation of the interior unsaturated bonds of the pyridines of the Ru-containing catalyst precursor. Based on this observation, the mechanism of amide hydrogenation may involve a two-step pathway, wherein the Ru catalyst having an H-Ru-N-H functionality is generated in the first step, followed by the amide carbonyl group interacting with the outer, rather than the inner, sphere of the Ru catalyst. (c) 2013 Elsevier Ltd. All rights reserved.