bis(2,4,6-tri(tert-butyl)phenyl)indium bromide | 155932-35-7

• 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: bis(2,4,6-tri(tert-butyl)phenyl)indium bromide
• 英文别名: (2,4,6-tBu3C6H2)2InBr；Bromobis(2,4,6-tri-t-butylphenyl)indium；bromo-bis(2,4,6-tritert-butylphenyl)indigane
• CAS: 155932-35-7
• 化学式: C₃₆H₅₈BrIn
• 分子量: 685.581
• InChiKey: JVUHMEMULJICEW-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  9.97
• 重原子数：
  38
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  bis(2,4,6-tri(tert-butyl)phenyl)indium bromide 以 neat (no solvent) 为溶剂， 以55%的产率得到In(Br)(C₆H₂(C(CH₃)3)3)(CH₂C(CH₃)2C₆H₃(C(CH₃)3)2)
  参考文献：
  名称：

  Synthesis of Indium(III) Supermesityl Derivatives (Supermesityl = Mes* = 2,4,6-^tBu₃(C₆H₂)). X-ray Crystal Structures of Mes*(Br)In[CH₂C(Me)₂C₆H₃(^tBu)₂] and Mes*In(SePh)₂

  摘要：

  Heating Mes*2InBr (Mes* = 2,4,6-(t)Bu(3)(C6H2)) at 130-150 degrees C under reduced pressure afforded the new isomer Mes*(Br)In[CH2C(CH3)(2)C6H3((t)Bu)(2)] (1) in 55% yield. The solid-state structure of 1 was determined by single-crystal X-ray crystallography. The resultant geometry around the indium center can be viewed as pseudo trigonal bipyramidal due to two close contacts of o-(t)Bu hydrogens on the Mes* groups, Reaction of IN-(SePh)(2)I with Mes*MgBr resulted in the quantitative formation of Mes*In(SePh)(2) (2). An X-ray structural analysis of 2 revealed a monomeric molecule.

  DOI：

  10.1021/om9603528
• 作为产物：
  描述：

  氯化铟 、 magnesium,1,3,5-tritert-butylbenzene-6-ide,bromide 以 四氢呋喃 为溶剂， 以85%的产率得到bis(2,4,6-tri(tert-butyl)phenyl)indium bromide
  参考文献：
  名称：

  Rahbarnoohi, Hamid; Heeg, Mary Jane; Oliver, John P., Organometallics, 1994, vol. 13, # 5, p. 2123 - 2126

  摘要：

  DOI：

文献信息

• Synthesis and characterization of 1,3-bis[2,4,6-tri(tert-butyl)phenyl]-2,4-bis[tri(tert-butyl)silyl]-1,3-diinda-2,4-diphosphetane, a dimeric phosphanylidene indane with three-coordinate indium and phosphorus atoms
  作者：Thomas Rotter、Alexander N. Kneifel、Peter Mayer、Matthias Westerhausen

  DOI：10.1016/j.inoche.2005.06.006

  日期：2005.9

  tri(tert-butyl)silylphosphanide with bis[2,4,6-tri(tert-butyl)phenyl]indium bromide gives (2,4,6-tBu3C6H2)2In–P(H)SitBu3 (1a), the subsequent elimination of tri(tert-butyl)benzene yields [(2,4,6-tBu3C6H2)In–PSitBu3]2 (2a) which can be regarded as a dimeric phosphanylidene indane. The X-ray structure confirms the dimeric nature of this 1,3-diinda-2,4-diphosphetane with three-coordinate indium and phosphorus

  摘要 三(叔丁基)甲硅烷基磷化钾与双[2,4,6-三(叔丁基)苯基]溴化铟的复分解反应得到(2,4,6-tBu3C6H2)2In-P(H)SitBu3 ( 1a)，随后消除三（叔丁基）苯产生 [(2,4,6-tBu3C6H2)In-PSitBu3]2 (2a)，可将其视为二聚亚膦基茚满。X 射线结构证实了这种具有三配位铟和磷原子以及 250 pm 的短 In-P 键长的 1,3-diinda-2,4-diphosphetane 的二聚体性质。与镓衍生物和较小的三异丙基甲硅烷基磷化钾的类似反应导致形成具有三配位镓和磷原子的单体 (2,4,6-tBu3C6H2)2Ga-P(H)SiiPr3 (1b)。