9-(3-蒽-9-基丙基)蒽 | 63934-10-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 中文名称: 9-(3-蒽-9-基丙基)蒽
• 英文名称: 9,9-trimethylenedianthracene
• 英文别名: bis-1,3-anthr-9,9'-ylpropane；bis(anthryl-9)-1.3-propane；1,3-bis(9-anthryl)propane；1,3-di(9-anthryl)propane；1,3-Di-(9-anthryl)-propan；9,9'-Bianthrylpropan；9,9'-(Propane-1,3-diyl)dianthracene；9-(3-anthracen-9-ylpropyl)anthracene
• CAS: 63934-10-1
• 化学式: C₃₁H₂₄
• 分子量: 396.532
• InChiKey: OQINKTWOPKQDEK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.7
• 重原子数：
  31
• 可旋转键数：
  4
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.1
• 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：

  9-(3-蒽-9-基丙基)蒽 在 tetraphenylporphyrin 作用下， 以 异丙醇 为溶剂， 反应 0.67h， 以98%的产率得到bis-1,2-anthr-9,9-ylethane bis-endoperoxide
  参考文献：
  名称：

  氧气蒽三明治复合物的证据

  摘要：

  乙炔之间存在氧气粘连：单线态氧对双（蒽）烷烃的光合氧化速率在确定的链长上显示出最大值（n = 4）。与计算相结合，仅一个内过氧化物和CT吸收带发生了UV / Vis吸收的红移，这为氧蒽三明治复合物提供了可观的证据。

  DOI：

  10.1002/anie.201304768
• 作为产物：
  描述：

  (+/-)-1,3-bis(9-anthryl)propan-1-ol 在 lithium aluminium tetrahydride 、 三氯化铝 作用下， 以 乙醚 为溶剂， 生成 9-(3-蒽-9-基丙基)蒽
  参考文献：
  名称：

  Charge transfer complex formation between p-chloranil and 1,n-di(9-anthryl)alkanes

  摘要：

  Dimer model compounds of polyvinylanthracenes (1,n-di(9-anthryl)alkanes, when n = 1-5) were synthesized to model the effects of distance and orientation between anthracene groups in polymeric systems. Charge transfer (CT) complexes of anthracene, 9-methylanthracene and 1,n-di(9-anthryl)alkanes with p-chloranil (p-CHL) have been investigated spectrophotometrically in dichloromethane. The colored products are measured spectrophotometrically at different wavelength depending on the electronic transition between donors and acceptor. The formation constants of the CT complexes were determined by the Benesi-Hildebrand equation. The thermodynamic parameters were calculated by Van't Hoff equation. Stochiometries of the complexes formed between donors and acceptor were defined by the Job's method of the continuous variation and found in 1:1 complexation with donor and acceptor at the maximum absorption bands. (c) 2005 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2005.07.073

文献信息

• Spectroscopy and photochemistry of a derivative of an anthracene-naphthalene phane
  作者：James Ferguson、Miroslav Puza、Raymond J. Robbins

  DOI：10.1021/ja00293a011

  日期：1985.4

  Etude concernant le tetrahydro-1,2,3,4 [2.3] anthracenophane-9,10 et le tetrahydro-1,2,3,4 trimethylene-9,9' bis-anthracene

  练习曲 le tetrahydro-1,2,3,4 [2.3] anthracenophane-9,10 et le tetrahydro-1,2,3,4 trimethyl-9,9'bis-anthracene
• Chiral recognition and molecular interaction in cellulose derivatives
  作者：Kenji Itoh、Tomiki Ikeda、Shigeo Tazuke、Tohru Shibata

  DOI：10.1021/j100193a020

  日期：1992.7

  Nineteen 1,3-bis(aryl)propane derivatives and six model compounds with a single chromophore were used to explore the chiral discrimination ability of cellulose derivatives, in particular cellulose triphenylcarbamate (CTC), in connection with the mode of interaction of these probe molecules with adsorbents. The interaction was evaluated by conformational analysis of the probe molecules and circular dichroism. Thc 1,3-bis(aryl)propanes with 9-anthryl moieties possessed a highly limited conformation owing to thc bulky substituent and hardly changed their shape on CTC as evidenced by CD spectra; thus, they may be regarded as ''rigid'' substrates. However, these ''rigid'' substrates were resolved quite effectively. On the other hand, those with 2-naphthyl moieties possessed a number of stable conformations and could change their shape in diastereomeric complexes on CTC; thus, they may be assumed as ''soft'' substrates, against which the chiral discrimination was inefficient. The present study revealed that the optical resolution may be interpreted at least partly in terms of the ''rigid'' and ''soft'' concept.
• Time-resolved observation of excitation hopping between two anthryl moieties attached to both ends of alkanes: simulation based on conformational analysis
  作者：Tomiki Ikeda、Bong Lee、Shigeo Tazuke、Akio Takenaka

  DOI：10.1021/ja00168a004

  日期：1990.6
• Charge transfer complex formation between p-chloranil and 1,n-di(9-anthryl)alkanes
  作者：Mustafa Arslan、John Masnovi

  DOI：10.1016/j.saa.2005.07.073

  日期：2006.6

  Dimer model compounds of polyvinylanthracenes (1,n-di(9-anthryl)alkanes, when n = 1-5) were synthesized to model the effects of distance and orientation between anthracene groups in polymeric systems. Charge transfer (CT) complexes of anthracene, 9-methylanthracene and 1,n-di(9-anthryl)alkanes with p-chloranil (p-CHL) have been investigated spectrophotometrically in dichloromethane. The colored products are measured spectrophotometrically at different wavelength depending on the electronic transition between donors and acceptor. The formation constants of the CT complexes were determined by the Benesi-Hildebrand equation. The thermodynamic parameters were calculated by Van't Hoff equation. Stochiometries of the complexes formed between donors and acceptor were defined by the Job's method of the continuous variation and found in 1:1 complexation with donor and acceptor at the maximum absorption bands. (c) 2005 Elsevier B.V. All rights reserved.
• Evidence for an Oxygen Anthracene Sandwich Complex
  作者：Matthias Klaper、Torsten Linker

  DOI：10.1002/anie.201304768

  日期：2013.11.4

  Oxygen sticks in between acenes: The rate of the photooxygenation of bis(anthryl)alkanes with singlet oxygen shows a maximum for a defined chain length (n=4). In combination with calculations, a bathochromic shift of the UV/Vis absorption for only one endoperoxide and a CT absorption band, this gives considerable evidence for an oxygen anthracene sandwich complex.

  乙炔之间存在氧气粘连：单线态氧对双（蒽）烷烃的光合氧化速率在确定的链长上显示出最大值（n = 4）。与计算相结合，仅一个内过氧化物和CT吸收带发生了UV / Vis吸收的红移，这为氧蒽三明治复合物提供了可观的证据。