2-[(1E)-1-丙烯-1-基]-1,3-苯并噻唑 | 66730-41-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻唑类
• 中文名称: 2-[(1E)-1-丙烯-1-基]-1,3-苯并噻唑
• 英文名称: trans-1-(2-benzothiazolyl)propene
• 英文别名: trans-2-benzothiazolyl-1-propene；2-(1-propenyl)benzothiazole；2-propenyl-benzothiazole；2-trans-propenyl-benzothiazole；2-trans-Propenyl-benzothiazol；2-(1-Propenyl)-benzthiazol；2-[(1E)-Prop-1-en-1-yl]-1,3-benzothiazole；2-[(E)-prop-1-enyl]-1,3-benzothiazole
• CAS: 66730-41-4
• 化学式: C₁₀H₉NS
• 分子量: 175.254
• InChiKey: QLIMKQNGGOYBRL-GORDUTHDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  41.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-[(1E)-1-丙烯-1-基]-1,3-苯并噻唑 在 sodium hydroxide 、 N-溴代丁二酰亚胺(NBS) 作用下， 生成 2-[(2R,3S)-3-methyloxiran-2-yl]-1,3-benzothiazole
  参考文献：
  名称：

  Stereoselective synthesis of vinylbenzothiazoles and their epoxides.

  摘要：

  Vinylbenzothiazoles 2 were stereoselectively prepared through isomerization of allylbenzothiazoles 1. Oxiranes 5 and 8 were synthesized from 2 and 1 via cyclization of the corresponding bromohydrins 3, 4, 6 and 7.

  DOI：

  10.1016/s0040-4020(01)86401-2
• 作为产物：
  描述：

  2-(2-丙烯基)-苯并噻唑 反应 600.0h， 生成 2-[(1E)-1-丙烯-1-基]-1,3-苯并噻唑
  参考文献：
  名称：

  Reversible allylic condensation of metalloallyls of heterocycles: counterion effect.

  摘要：

  DOI：

  10.1016/s0040-4020(01)81444-7

文献信息

• ORGANIC SEMICONDUCTING COMPOUNDS
  申请人：RAYNERGY TEK INC.

  公开号：US20210070770A1

  公开（公告）日：2021-03-11

  The invention relates to novel organic semiconducting compounds containing a polycyclic unit, to methods for their preparation and educts or intermediates used therein, to compositions, polymer blends and formulations containing them, to the use of the compounds, compositions and polymer blends as organic semiconductors in, or for the preparation of, organic electronic (OE) devices, especially organic photovoltaic (OPV) devices, perovskite-based solar cell (PSC) devices, organic photodetectors (OPD), organic field effect transistors (OFET) and organic light emitting diodes (OLED), and to OE, OPV, PSC, OPD, OFET and OLED devices comprising these compounds, compositions or polymer blends.

  该发明涉及含有多环单元的新型有机半导体化合物，以及其制备方法、所使用的底物或中间体，含有它们的组合物、聚合物混合物和配方，以及将这些化合物、组合物和聚合物混合物用作有机半导体的用途，或用于制备有机电子（OE）器件，特别是有机光伏（OPV）器件、钙钛矿太阳能电池（PSC）器件、有机光电探测器（OPD）、有机场效应晶体管（OFET）和有机发光二极管（OLED），以及包括这些化合物、组合物或聚合物混合物的OE、OPV、PSC、OPD、OFET和OLED器件。
• FLUORINATED DYE COMPOUNDS FOR ORGANIC SOLAR CELLS
  申请人：Next Energy Technologies, Inc.

  公开号：US20180114930A1

  公开（公告）日：2018-04-26

  Electronic or optoelectronic device comprising a first electrode, a second electro, and an active layer arranged between and in electrical connection with the first and the second electrode. The active layer comprises at least one dye compound, which comprises small-molecule organic solar cells.

  包含第一电极、第二电极和位于第一电极和第二电极之间并与其电连接的有源层的电子或光电子器件。该有源层包括至少一种染料化合物，其中包括小分子有机太阳能电池。
• Palladium-Catalyzed Coupling between Organic Halides and Organotin Compounds Involving C-N Unsaturated Bonds at the Reaction Centers
  作者：Masanori Kosugi、Mamoru Koshiba、Akira Atoh、Hiroshi Sano、Toshihiko Migita

  DOI：10.1246/bcsj.59.677

  日期：1986.2

  Imidoyl chlorides were good substrates which can react with a variety of organotin compounds to give ketimines in the presence of a catalytic amount of palladium complex. Under similar conditions, C-tributylstannyl imines did not give the products except with 2-(tributylstannyl)benzothiazole, -benzoxazole, and 1-methyl 2-(tributylstannyl)imidazole. And N-tributylstannyl imines could not be utilized

  亚氨酰氯是良好的底物，可在催化量的钯配合物存在下与多种有机锡化合物反应生成酮亚胺。在类似条件下，C-三丁基甲锡亚胺除与 2-(三丁基甲锡烷基)苯并噻唑、-苯并恶唑和 1-甲基 2-(三丁基甲锡烷基)咪唑一起产生外，不产生产物。并且不能使用N-三丁基甲锡亚胺。
• NOVEL TRIPHENYLAMINE DERIVATIVES USEFUL AS FLUOROPHORES IN BIOLOGY, IN PARTICULAR FOR TWO-PHOTON MICROSCOPY
  申请人：Allain Clémence

  公开号：US20090314990A1

  公开（公告）日：2009-12-24

  Triphenylamine derivatives useful as fluorophores in biology, in particular for two-photon microscopy; and compositions comprising these derivatives, to the use of these compositions and of the derivatives themselves for labelling biological molecules (or “biomolecules”) such as nucleic acids, oligonucleotides, proteins, polypeptides, plasmids, and the like, for their examination in particular by two-photon microscopy, and to biomolecules labelled with the said derivatives.

  三苯胺衍生物在生物学中作为荧光染料特别是用于双光子显微镜的有用性；以及包含这些衍生物的组合物，使用这些组合物和衍生物本身来标记生物分子（或“生物分子”）如核酸、寡核苷酸、蛋白质、多肽、质粒等，特别是通过双光子显微镜对它们进行检测，并且标记有上述衍生物的生物分子。
• PHOTOELECTRIC MATERIALS AND PREPARATION THEREOF
  申请人：Chen Yongsheng

  公开号：US20140142308A1

  公开（公告）日：2014-05-22

  Receptor type oligothiopene compounds, methods of preparing the compounds, and use of the compounds in photoelectric materials.

  受体型寡硫杂苯化合物，制备该化合物的方法，以及在光电材料中使用该化合物的方法。