1,4-二庚基苯 | 40775-32-4

• 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: 1,4-二庚基苯
• 英文名称: 1,4-diheptylbenzene
• 英文别名: 1,4-Diheptyl-benzol；Di-p-heptylbenzene
• CAS: 40775-32-4
• 化学式: C₂₀H₃₄
• 分子量: 274.49
• InChiKey: HPSGOXKMDPLMQY-UHFFFAOYSA-N

物化性质

• 熔点：
  -13 °C
• 沸点：
  179-180 °C(Press: 4 Torr)
• 密度：
  0.8563 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  8.9
• 重原子数：
  20
• 可旋转键数：
  12
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.7
• 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：

  1,4-二庚基苯 在 硫酸 作用下， 生成 1,4-Diheptyl-benzol-2-sulfonsaeure
  参考文献：
  名称：

  Asinger,F. et al., Journal fur praktische Chemie (Leipzig 1954), 1963, vol. 22, p. 290 - 303

  摘要：

  DOI：
• 作为产物：
  描述：

  庚基苯 在 氢氧化钾 、 三氯化铝 、 一水合肼 作用下， 反应 2.0h， 生成 1,4-二庚基苯
  参考文献：
  名称：

  Asinger,F. et al., Journal fur praktische Chemie (Leipzig 1954), 1963, vol. 22, p. 153 - 172

  摘要：

  DOI：

文献信息

• Preparation of Poly(2,5-diheptyl-1,4-phenylenevinylene) by Sulfonium Salt Pyrolysis
  作者：Yoriko Sonoda、Kyoji Kaeriyama

  DOI：10.1246/bcsj.65.853

  日期：1992.3

  Poly(2,5-diheptyl-1,4-phenylenevinylene) (1) was prepared by the sulfonium salt pyrolysis procedure. Tough films of 1 were obtained by pyrolysis of its sulfonium salt precursor film. Due to flexible side chains, 1 was soluble in organic solvents such as chloroform. The molecular weights were Mn = 3.8−4.7 × 104 and Mw = 1.4−1.8 × 105. The ratio of trans to cis olefinic units was found to be 93 : 7 from the 1H NMR spectrum. Two arylmethylene peaks suggested that there were two kinds of stereochemically different methylene groups. Although the peak energy in the absorption spectra was almost identical to those of poly(1,4-phenylenevinylene) (PPV), the electrical conductivity of 1 was much lower than that of PPV.

  聚(2,5-二庚基-1,4-苯乙烯) (1) 是通过季铵盐热解法制备的。通过热解其季铵盐前驱体薄膜获得了坚韧的薄膜。由于有柔性的侧链，1可溶于氯仿等有机溶剂。其分子量为 Mn = 3.8−4.7 × 10^4 和 Mw = 1.4−1.8 × 10^5。通过1H NMR光谱发现反式与顺式烯烃单元的比例为93 : 7。两个芳烯亚甲基峰表明存在两种立体化学上不同的亚甲基。尽管吸收光谱中的峰值能量几乎与聚(1,4-苯乙烯) (PPV) 相同，但1的电导率远低于PPV。
• Simonsen, Klaus B.; Svenstrup, Niels; Roberson, Mark, Chemistry - A European Journal, 2000, vol. 6, # 1, p. 123 - 128
  作者：Simonsen, Klaus B.、Svenstrup, Niels、Roberson, Mark、Jorgensen, Karl Anker

  DOI：——

  日期：——
• Nikishin,G.I. et al., Journal of general chemistry of the USSR, 1960, vol. 30, p. 3515 - 3520
  作者：Nikishin,G.I. et al.

  DOI：——

  日期：——
• Two Flavors of PEPPSI-IPr: Activation and Diffusion Control in a Single NHC-Ligated Pd Catalyst?
  作者：Igor Larrosa、Clara Somoza、Alexandre Banquy、Stephen M. Goldup

  DOI：10.1021/ol1027283

  日期：2011.1.7

  Abnormal reactivity has been observed in Negishi, Suzuki Miyaura, and Kumada Tamao Corriu cross-couplings in which PEPPSI-IPr (where PEPPSI stands for pyridine enhanced precatalyst preparation, stabilization, and initiation and IPr refers to the NHC ligand) is employed, implicating the presence of two distinct Pd-0 species in the catalytic cycle. Polybrominated arenes and organometallic reagents react selectively to give the product of exhaustive polysubstitution regardless of the initial reaction stoichiometry. Competition experiments suggest that, after an initial activation controlled oxidative addition, reductive elimination produces an ultrareactive Pd-0 species which consumes all remaining C-Br bonds in the molecule under diffusion control.
• Kuliev,A.M. et al., Journal of Organic Chemistry USSR (English Translation), 1971, vol. 7, p. 1011 - 1015
  作者：Kuliev,A.M. et al.

  DOI：——

  日期：——