Carbon monoxide;chlororuthenium(1+);prop-1-ene;triphenylphosphane | 200358-51-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Carbon monoxide;chlororuthenium(1+);prop-1-ene;triphenylphosphane
• CAS: 200358-51-6；155516-31-7
• 化学式: C₄₀H₃₅ClOP₂Ru
• 分子量: 730.188
• InChiKey: YEOGZZOIQLLSOO-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  8.55
• 重原子数：
  45
• 可旋转键数：
  6
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  Carbon monoxide;chlororuthenium(1+);prop-1-ene;triphenylphosphane 、 sodium dimethyldithiocarbamate 以 乙醇 、 二氯甲烷 为溶剂， 生成 RuH(κ2-S2CNMe2)(CO)(PPh3)2
  参考文献：
  名称：

  The coupling of methylene and vinyl ligands at a ruthenium(II) centre

  摘要：

  Ru(CHCH2)Cl(CO)(PPh3)2]与重氮甲烷反应生成烯丙基络合物[Ru(η3-CH2CHCH2)Cl(CO)(PPh3)2]，它也是[RuHCl(CO)(PPh3)3]与烯丙基或丙炔反应的产物，随后与 NaS2CNMe2 反应生成[RuH(S2CNMe2)(CO)(PPh3)2]和烯丙基。

  DOI：

  10.1039/a704157h
• 作为产物：
  描述：

  [RuHCl(CO)(PPh₃)₃] 、 丙炔 以 四氢呋喃 为溶剂， 以84%的产率得到Carbon monoxide;chlororuthenium(1+);prop-1-ene;triphenylphosphane
  参考文献：
  名称：

  The coupling of methylene and vinyl ligands at a ruthenium(II) centre

  摘要：

  Ru(CHCH2)Cl(CO)(PPh3)2]与重氮甲烷反应生成烯丙基络合物[Ru(η3-CH2CHCH2)Cl(CO)(PPh3)2]，它也是[RuHCl(CO)(PPh3)3]与烯丙基或丙炔反应的产物，随后与 NaS2CNMe2 反应生成[RuH(S2CNMe2)(CO)(PPh3)2]和烯丙基。

  DOI：

  10.1039/a704157h

文献信息

• Reactions of RuClH(CO)(PPh3)3 with Allylic Amines: Insertions and an Unusual Carbon-Nitrogen Bond Cleavage of Allylic Amines
  作者：Katsuma Hiraki、Takahiro Matsunaga、Hiroyuki Kawano

  DOI：10.1021/om00017a051

  日期：1994.5

  Reactions between RuClH(CO)(PPh3)3 and primary or secondary allylamines give olefin-insertion products: Ru(CH2CH2CH2NHR)Cl(CO)(PPh3)2(R=H(1),CH3(4), and CH2CH=CH2 (5)). Analytical and spectroscopic studies on these products show they have an octahedral six-coordinate structure in which two triphenylphosphines are located mutually cis, and a phosphine-trans isomer is obtained only in the case of R=H. The insertion of the primary allylamine occurs after the initial ligand exchange of the allylamine with one PPh3 of the starting complex. The variable-temperature NMR analyses reveal that the complexes derived from the secondary allylamines liberate one of the two PPh3 ligands at high temperatures. When R = CH3, an isolable dichloro-bridged dinuclear complex [Ru(mu-Cl)(CH2CH2CH2NHCH3)(CO)(PPh3)-]2 (6) is formed by the liberation of PPh3. A carbon-nitrogen bond of some tertiary allylic amines is cleaved in the reaction with RuClH(CO) (PPh3)3 to give the (pi-allyl)ruthenium(II) complex Ru(eta3-C3H5)CI(CO)(PPh3)2 (7) and its analog. The direct interaction between the Ru-H bond and the allylic amine leads to the formation of the (pi-allyl)ruthenium(II) complex, and the corresponding secondary amine without an increase of the oxidation state. Catalytic isomerization of some allylic amines to the enamines is also recognized during the insertion and the carbon-nitrogen bond cleavage.