1,1,5,5-Tetracyanopentadien | 120879-65-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1,1,5,5-Tetracyanopentadien
• 英文别名: 1,1,5,5-Tetracyan-penta-1,3-dien；penta-1,3t-diene-1,1,5,5-tetracarbonitrile；Penta-1,3t-dien-1,1,5,5-tetracarbonitril；(3E)-penta-1,3-diene-1,1,5,5-tetracarbonitrile
• CAS: 120879-65-4
• 化学式: C₉H₄N₄
• 分子量: 168.158
• InChiKey: QDXJJOSPIHZHMZ-OWOJBTEDSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  95.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1,1,5,5-Tetracyanopentadien 、 1-Ethyl-2-{(E)-3-[1-ethyl-3,4-dihydro-1H-quinolin-(2E)-ylidene]-propenyl}-3,4-dihydro-quinolinium 以 乙醇 为溶剂， 以65%的产率得到
  参考文献：
  名称：

  Novel polymethine dyes derived from aminals and aminal-acetals of conjugated ?-dimethylaminoaldehydes

  摘要：

  DOI：

  10.1007/bf00953705
• 作为产物：
  描述：

  1,3-Bis-dimethylamino-3-methoxy-propen-(1) 、 丙二腈 以 苯 为溶剂， 反应 1.0h， 以80%的产率得到1,1,5,5-Tetracyanopentadien
  参考文献：
  名称：

  Novel polymethine dyes derived from aminals and aminal-acetals of conjugated ?-dimethylaminoaldehydes

  摘要：

  DOI：

  10.1007/bf00953705

文献信息

• HALOGENATED COMPOUNDS FOR PHOTODYNAMIC THERAPY
  申请人：Jones Gary W.

  公开号：US20130231604A1

  公开（公告）日：2013-09-05

  Halo-organic heterocyclic compounds are described, in which at least two halogen atoms are bound to a nitrogen-containing heterocyclic terminal moiety of the compound, with at least one of such halogen atoms being iodine or bromine. Also described are polymethine dyes based on these heterocyclic compounds, and dendrimeric compounds and conjugates of such polymethine dyes. The polymethine dyes are characterized by enhanced properties, e.g., brightness, photostability, sensitivity and/or selective affinity that make them useful to target cancer cells, pathogenic microorganisms, and/or other biological materials, in applications such as photodynamic therapy, photodynamic antimicrobial chemotherapy (PACT), cancer treatment, selective removal or attachment of biological materials, antimicrobial coating materials, and other diagnostic, theranostic, spectrum shifting, deposition/growth, and analytic applications.

  描述了卤素有机杂环化合物，其中至少有两个卤素原子与化合物的含氮杂环末端基团结合，其中至少一个卤素原子为碘或溴。还描述了基于这些杂环化合物的聚甲烯染料，以及这些聚甲烯染料的树枝状化合物和共轭物。这些聚甲烯染料具有增强的性能，例如亮度、光稳定性、灵敏度和/或选择性亲和力，使它们在靶向癌细胞、病原微生物和/或其他生物材料的应用中具有用途，例如光动力疗法、光动力抗微生物化疗（PACT）、癌症治疗、选择性去除或附着生物材料、抗微生物涂层材料以及其他诊断、治疗学、光谱转移、沉积/生长和分析应用。
• KRASNAYA, ZH. A.;STYTSENKO, T. S.;AVDEEVA, V. P.;SHAGALOVA, D. YA., IZV. AN CCCP. CEP.,(1989) N, S. 92-98
  作者：KRASNAYA, ZH. A.、STYTSENKO, T. S.、AVDEEVA, V. P.、SHAGALOVA, D. YA.

  DOI：——

  日期：——
• LENS FOR SPECTACLES AND SPECTACLES
  申请人：FUJIFILM Corporation

  公开号：US20210017358A1

  公开（公告）日：2021-01-21

  Provided are a lens for spectacles containing a resin and a coloring agent having a maximum absorption wavelength in a methanol solution in a range of 400 nm to 500 nm and a half-width of an absorption peak in a methanol solution of 10 nm or more and less than 40 nm, and spectacles.
• [EN] HALOGENATED COMPOUNDS FOR PHOTODYNAMIC THERAPY<br/>[FR] COMPOSÉS HALOGÉNÉS POUR THÉRAPIE PHOTODYNAMIQUE
  申请人：NANOQUANTUM SCIENCES INC

  公开号：WO2013134081A2

  公开（公告）日：2013-09-12

  Halo-organic heterocyclic compounds are described, in which at least two halogen atoms are bound to a nitrogen-containing heterocyclic terminal moiety of the compound, with at least one of such halogen atoms being iodine or bromine. Also described are polymethine dyes based on these heterocyclic compounds, and dendrimeric compounds and conjugates of such polymethine dyes. The polymethine dyes are characterized by enhanced properties, e.g., brightness, photostability, sensitivity and/or selective affinity that make them useful to target cancer cells, pathogenic microorganisms, and/or other biological materials, in applications such as photodynamic therapy, photodynamic antimicrobial chemotherapy (PACT), cancer treatment, selective removal or attachment of biological materials, antimicrobial coating materials, and other diagnostic, theranostic, spectrum shifting, deposition/growth, and analytic applications.
• Novel polymethine dyes derived from aminals and aminal-acetals of conjugated ?-dimethylaminoaldehydes
  作者：Zh. A. Krasnaya、T. S. Stytsenko、V. I. Avdeeva、D. Ya. Shagalova

  DOI：10.1007/bf00953705

  日期：1989.1