1,2,4-三(2-甲基丁基)苯 | 61064-06-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 1,2,4-三(2-甲基丁基)苯
• 英文名称: 1,2,4-tri(2-methylbutyl)benzene
• 英文别名: Benzene, 1,2,4-tris(2-methylbutyl)-；1,2,4-tris(2-methylbutyl)benzene
• CAS: 61064-06-0
• 化学式: C₂₁H₃₆
• 分子量: 288.517
• InChiKey: CMVHJAMPQJPDLI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.3
• 重原子数：
  21
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  4-甲基-1-己炔 在 (η(6)-cyclohepta-1,3,5-triene)(η(4)-cycloocta-1,5-diene)iron(0) 作用下， 以 四氢呋喃 为溶剂， 反应 46.0h， 生成 1,3,5-三(2-甲基丁基)苯 、 1,2,4-三(2-甲基丁基)苯
  参考文献：
  名称：

  (η6-Cyclohepta-1,3,5-triene)(η4-cycloocta-1,5-diene)iron(0) complex as attractive precursor in catalysis

  摘要：

  The catalytic activity of the complex Fe(eta(6)-CHT)(eta(4)-COD), (CHT = 1,3,5-cycloheptatriene; COD = 1,5-cyclooctadiene), 1, has been evaluated in some reference reactions such as the hydroformylation of 1-hexene and styrene and the cyclotrimerisation of a wide range of terminal and internal acetylenes. The title complex has been found to be a convenient catalytic precursor and it resulted more active than other iron catalysts in the investigated reactions. (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0022-328x(00)00211-4

文献信息

• CAPORUSSO A. M.; GIACOMELLI G.; LARDICCI L., J. ORG. CHEM., 1979, 44, NO 9, 1495-1501
  作者：CAPORUSSO A. M.、 GIACOMELLI G.、 LARDICCI L.

  DOI：——

  日期：——
• (η6-Cyclohepta-1,3,5-triene)(η4-cycloocta-1,5-diene)iron(0) complex as attractive precursor in catalysis
  作者：Chiara Breschi、Loris Piparo、Paolo Pertici、Anna Maria Caporusso、Giovanni Vitulli

  DOI：10.1016/s0022-328x(00)00211-4

  日期：2000.8

  The catalytic activity of the complex Fe(eta(6)-CHT)(eta(4)-COD), (CHT = 1,3,5-cycloheptatriene; COD = 1,5-cyclooctadiene), 1, has been evaluated in some reference reactions such as the hydroformylation of 1-hexene and styrene and the cyclotrimerisation of a wide range of terminal and internal acetylenes. The title complex has been found to be a convenient catalytic precursor and it resulted more active than other iron catalysts in the investigated reactions. (C) 2000 Elsevier Science S.A. All rights reserved.