2,15-bis(bromomethyl)hexahelicene | 174653-48-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: 2,15-bis(bromomethyl)hexahelicene
• CAS: 174653-48-6
• 化学式: C₂₈H₁₈Br₂
• 分子量: 514.259
• InChiKey: QZYITJLHRHYDRQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.3
• 重原子数：
  30
• 可旋转键数：
  2
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.07
• 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：

  2,15-bis(bromomethyl)hexahelicene 在 2-硝基丙烷钠盐 作用下， 以 乙醇 、 苯 为溶剂， 以72%的产率得到hexahelicene-2,15-dicarbaldehyde
  参考文献：
  名称：

  Yamamoto, Koji; Sonobe, Hiroyuki; Matsubara, Hiroshi, Angewandte Chemie, 1996, vol. 108, # 1, p. 69 - 70

  摘要：

  DOI：
• 作为产物：
  描述：

  2,15-dimethylhexahelicene 在 N-溴代丁二酰亚胺(NBS) 、 过氧化苯甲酰 作用下， 以 四氯化碳 为溶剂， 以65%的产率得到2,15-bis(bromomethyl)hexahelicene
  参考文献：
  名称：

  Assembling Nonplanar Polyaromatic Units by Click Chemistry. Study of Multicorannulene Systems as Host for Fullerenes

  摘要：

  Novel compounds with two or three corannulene subunits have been obtained by click chemistry. These exotic systems were synthesized in high yields using the ethynylcorannulene as common reagent. The synergistic action as receptors for fullerenes of several corannulene blocks has been evaluated. It was found that the three-armed derivatives showed efficient complexation abilities toward C-60. Furthermore, a new compound having two corannulene subunits linked to a hexahelicene scaffold has a remarkable affinity constant. Finally, theoretical calculations have been performed to evaluate the formation of their relative adducts containing a C-60 molecule.

  DOI：

  10.1021/acs.orglett.5b01161

文献信息

• Yamamoto, Koji; Sonobe, Hiroyuki; Matsubara, Hiroshi, Angewandte Chemie, 1996, vol. 108, # 1, p. 69 - 70
  作者：Yamamoto, Koji、Sonobe, Hiroyuki、Matsubara, Hiroshi、Sato, Masaaki、Okamoto, Susumu、Kitaura, Kazuo

  DOI：——

  日期：——
• Assembling Nonplanar Polyaromatic Units by Click Chemistry. Study of Multicorannulene Systems as Host for Fullerenes
  作者：Celedonio M. Álvarez、Gabriel Aullón、Héctor Barbero、Luis A. García-Escudero、Cristina Martínez-Pérez、Jose M. Martín-Álvarez、Daniel Miguel

  DOI：10.1021/acs.orglett.5b01161

  日期：2015.6.5

  Novel compounds with two or three corannulene subunits have been obtained by click chemistry. These exotic systems were synthesized in high yields using the ethynylcorannulene as common reagent. The synergistic action as receptors for fullerenes of several corannulene blocks has been evaluated. It was found that the three-armed derivatives showed efficient complexation abilities toward C-60. Furthermore, a new compound having two corannulene subunits linked to a hexahelicene scaffold has a remarkable affinity constant. Finally, theoretical calculations have been performed to evaluate the formation of their relative adducts containing a C-60 molecule.
• Sato, Masaaki; Yamamoto, Kazuyuki; Sonobe, Hiroyuki, Journal of the Chemical Society. Perkin Transactions 2 (2001), 1998, # 9, p. 1909 - 1913
  作者：Sato, Masaaki、Yamamoto, Kazuyuki、Sonobe, Hiroyuki、Yano, Koji、Matsubara, Hiroshi、Fujita, Hideo、Sugimoto, Toyonari、Yamamoto, Koji

  DOI：——

  日期：——