3,6-di(furan-2-yl)-2,5-dihexadecyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1 4-dione | 1356822-35-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 杂芳族化合物
• 英文名称: 3,6-di(furan-2-yl)-2,5-dihexadecyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1 4-dione
• 英文别名: 2,5-dihexadecyl-3,6-di(furan-2-yl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione；1,4-Bis(furan-2-yl)-2,5-dihexadecylpyrrolo[3,4-c]pyrrole-3,6-dione
• CAS: 1356822-35-9
• 化学式: C₄₆H₇₂N₂O₄
• 分子量: 717.089
• InChiKey: VFMYBJCJNSRJMG-UHFFFAOYSA-N

物化性质

• 沸点：
  795.9±60.0 °C(Predicted)
• 密度：
  1.04±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  15.9
• 重原子数：
  52
• 可旋转键数：
  32
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  66.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3,6-di(furan-2-yl)-2,5-dihexadecyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1 4-dione 在 N-溴代丁二酰亚胺(NBS) 作用下， 以 氯仿 为溶剂， 生成 3,6-bis(5-bromofuran-2-yl)-2,5-dihexadecyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1,4-dione
  参考文献：
  名称：

  Diketopyrrolopyrrole-based semiconducting polymer nanoparticles forin vivosecond near-infrared window imaging and image-guided tumor surgery

  摘要：

  PDFT1032是一种新的半导体聚合物，具有良好的吸收峰（1032纳米）和出色的生物相容性，可能广泛应用于临床成像和恶性肿瘤的外科治疗。

  DOI：

  10.1039/c8sc00206a
• 作为产物：
  描述：

  2-氰基呋喃 在 sodium tert-pentoxide 作用下， 以 2-甲基-2-丁醇 、 N,N-二甲基甲酰胺 为溶剂， 生成 3,6-di(furan-2-yl)-2,5-dihexadecyl-2,5-dihydropyrrolo[3,4-c]pyrrole-1 4-dione
  参考文献：
  名称：

  Diketopyrrolopyrrole-based semiconducting polymer nanoparticles forin vivosecond near-infrared window imaging and image-guided tumor surgery

  摘要：

  PDFT1032是一种新的半导体聚合物，具有良好的吸收峰（1032纳米）和出色的生物相容性，可能广泛应用于临床成像和恶性肿瘤的外科治疗。

  DOI：

  10.1039/c8sc00206a

文献信息

• COMPOUNDS FOR INFRARED LIGHT SENSING DEVICES, INFRARED LIGHT SENSING DEVICES, IMAGE SENSORS, AND ELECTRONIC DEVICES INCLUDING THE SAME
  申请人：Samsung Electronics Co., Ltd.

  公开号：US20180315933A1

  公开（公告）日：2018-11-01

  A compound for an infrared light sensing device may be represented by a particular chemical formula and may be included in an infrared light sensing device. An image sensor may include the infrared light sensing device, and an electronic device may include the image sensor.

  红外光感应装置的化合物可以用特定的化学式表示，并可包含在红外光感应装置中。图像传感器可能包括红外光感应装置，并且电子设备可能包括图像传感器。
• Furan Conjugated Polymers Useful for Photovoltaic Applications
  申请人：Beaujuge Pierre M.

  公开号：US20120085992A1

  公开（公告）日：2012-04-12

  The present invention provides for a polymer comprising a π-conjugated backbone comprising a furan. The polymer has a narrow or low band gap and/or is solution processable. In some embodiments, the polymer is PDPP2FT or PDPP3F. The present invention also provides for a device comprising the polymer, such as a light-emitting diode, thin-film transistor, chemical biosensor, non-emissive electrochromic, memory device, photovoltaic cells, or the like.

  本发明提供了一种聚合物，其包括一个π-共轭骨架，其中包括呋喃。该聚合物具有窄或低带隙和/或可溶解性。在某些实施例中，该聚合物是PDPP2FT或PDPP3F。本发明还提供了一种包括该聚合物的器件，例如发光二极管、薄膜晶体管、化学生物传感器、非发光电致变色、记忆器件、光伏电池等。
• Compounds for infrared light sensing devices, infrared light sensing devices, image sensors, and electronic devices including the same
  申请人：Samsung Electronics Co., Ltd.

  公开号：US10950800B2

  公开（公告）日：2021-03-16

  A compound for an infrared light sensing device may be represented by a particular chemical formula and may be included in an infrared light sensing device. An image sensor may include the infrared light sensing device, and an electronic device may include the image sensor.

  用于红外光感应装置的化合物可用特定化学式表示，并可包含在红外光感应装置中。图像传感器可包括红外光感应装置，电子设备可包括图像传感器。
• Side-Chain Tunability of Furan-Containing Low-Band-Gap Polymers Provides Control of Structural Order in Efficient Solar Cells
  作者：Alan T. Yiu、Pierre M. Beaujuge、Olivia P. Lee、Claire H. Woo、Michael F. Toney、Jean M. J. Fréchet

  DOI：10.1021/ja2089662

  日期：2012.2.1

  The solution-processability of conjugated polymers in organic solvents has classically been achieved by modulating the size and branching of alkyl substituents appended to the backbone. However, these substituents impact structural order and charge transport properties in thin-film devices. As a result, a trade-off must be found between material solubility and insulating alkyl content. It was recently shown that the substitution of furan for thiophene in the backbone of the polymer PDPP2FT significantly improves polymer solubility, allowing for the use of shorter branched side chains while maintaining high device efficiency. In this report, we use PDPP2FT to demonstrate that linear alkyl side chains can be used to promote thin-film nanostructural order. In particular, linear side chains are shown to shorten pi-pi stacking distances between backbones and increase the correlation lengths of both pi-pi stacking and lamellar spacing, leading to a substantial increase in the efficiency of bulk heterojunction solar cells.
• Diketopyrrolopyrrole-based semiconducting polymer nanoparticles for<i>in vivo</i>second near-infrared window imaging and image-guided tumor surgery
  作者：Kangquan Shou、Yufu Tang、Hao Chen、Si Chen、Lei Zhang、Ao Zhang、Quli Fan、Aixi Yu、Zhen Cheng

  DOI：10.1039/c8sc00206a

  日期：——

  PDFT1032, a new semiconducting polymer possessing a favorable absorption peak (1032 nm) and outstanding biocompatibility, may be widely applicable in clinical imaging and the surgical treatment of malignancy.

  PDFT1032是一种新的半导体聚合物，具有良好的吸收峰（1032纳米）和出色的生物相容性，可能广泛应用于临床成像和恶性肿瘤的外科治疗。