2,3-二氰基-1,4-二羟基-5-硝基萘 | 4655-62-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 中文名称: 2,3-二氰基-1,4-二羟基-5-硝基萘
• 英文名称: 2,3-Dicyano-5-nitro-naphtho-1,4-hydrochinon
• 英文别名: 1,4-dihydroxy-5-nitro-2,3-naphthalenedicarbonitrile；2,3-Dicyano-1,4-dihydroxy-5-nitronaphthalene；1,4-dihydroxy-5-nitronaphthalene-2,3-dicarbonitrile
• CAS: 4655-62-3
• 化学式: C₁₂H₅N₃O₄
• 分子量: 255.189
• InChiKey: FFSZGCAJTTUCCU-UHFFFAOYSA-N

物化性质

• 沸点：
  609.2±55.0 °C(Predicted)
• 密度：
  1.70±0.1 g/cm3(Predicted)
• 溶解度：
  略溶。在乙醇中
• 稳定性/保质期：
  在常温常压下保持稳定

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  19
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  134
• 氢给体数：
  2
• 氢受体数：
  6

安全信息

• 危险等级：
  6.1

反应信息

• 作为反应物：
  描述：

  2,3-二氰基-1,4-二羟基-5-硝基萘 、 氯化亚锡 以93%的产率得到
  参考文献：
  名称：

  NAKAMORI TATEO; CHIBA TUNEO; KASAI TOSHIYASU, NIXON KAGAKU KAJSI, NIRRON KAGAKU KAISNI, J. CHEM. SOS. JAR., CHEM. AND I+

  摘要：

  DOI：
• 作为产物：
  描述：

  2,3-二氯-5-硝基-1,4-萘醌 、 氰化钠 以46%的产率得到
  参考文献：
  名称：

  NAKAMORI TATEO; CHIBA TUNEO; KASAI TOSHIYASU, NIXON KAGAKU KAJSI, NIRRON KAGAKU KAISNI, J. CHEM. SOS. JAR., CHEM. AND I+

  摘要：

  DOI：

文献信息

• [EN] NEW AROMATIC MACROCYCLIC METAL COMPLEX DYES AND THE SYNTHESIS THEREOF WITH ACTIVE NANO METAL POWDERS<br/>[FR] NOUVEAUX COLORANTS COMPLEXES MÉTALLIQUES MACROCYCLIQUES AROMATIQUES ET LEUR SYNTHÈSE À PARTIR DE NANO-POUDRES MÉTALLIQUES ACTIVES
  申请人：OLGUN UĞURSOY

  公开号：WO2015199628A1

  公开（公告）日：2015-12-30

  The present invention relates to a new type of inorganic coordination compound dyes having advanced technology optical, electronic and medical characteristics and relates to production of these dyes by means of new synthesis methods. The present invention relates to dyes which are metal (M: Li, Na, K, Mg, Ca, Sr, Ba, Ti, Zr, V, Cr, Mo, Mn, Re, Fe, Ru, Co, Rh, Ir, Ni, Pd, Pt, Cu, Ag, Au, Zn, Cd, B, Al, Ga, In, Si, Ge, Sn, Pb, Sb, Bi, Se, Te) complexes of aromatic macrocyclic compounds of the type Phtalocyanine (Pc), Naphtalocyanine (Nc), Porphyrazine (Pz), Porphyrine (Pr), sub-Phtalocyanine (subPc), sub-Naphtalocyanine (subNc), sub-Porphyrazine (subPz), sub-Porphyrine (subPr), and relates to the synthesis of these complexes and derivatives. The subject matter dyes can be used in solar cell photovoltaic (PV) panels, in OLEDS which are organic structured light emitting diodes, in polymers, in textile and in photodynamic therapy PDT applications. Moreover, industrial applications are possible which depend on strong fluorescence characteristics.

  本发明涉及一种具有先进技术光学、电子和医学特性的新型无机配位化合物染料，以及通过新合成方法生产这些染料。本发明涉及金属（M：Li、Na、K、Mg、Ca、Sr、Ba、Ti、Zr、V、Cr、Mo、Mn、Re、Fe、Ru、Co、Rh、Ir、Ni、Pd、Pt、Cu、Ag、Au、Zn、Cd、B、Al、Ga、In、Si、Ge、Sn、Pb、Sb、Bi、Se、Te）的芳香大环化合物（如酞菁（Pc）、萘酞菁（Nc）、卟啉（Pz）、卟啉（Pr）、亚酞菁（subPc）、亚萘酞菁（subNc）、亚卟啉（subPz）、亚卟啉（subPr））的配合物染料，并涉及这些配合物和衍生物的合成。所述染料可用于太阳能电池光伏（PV）面板、有机结构发光二极管（OLED）、聚合物、纺织品和光动力疗法（PDT）应用。此外，还可能存在依赖于强荧光特性的工业应用。
• NAKAMORI TATEO; CHIBA TUNEO; KASAI TOSHIYASU, NIXON KAGAKU KAJSI, NIRRON KAGAKU KAISNI, J. CHEM. SOS. JAR., CHEM. AND I+
  作者：NAKAMORI TATEO、 CHIBA TUNEO、 KASAI TOSHIYASU

  DOI：——

  日期：——
• SIMULATION OF NORMAL FRESH BLOOD PLATELETS
  申请人：Bio-Rad Laboratories, Inc.

  公开号：EP2376908A1

  公开（公告）日：2011-10-19
• NEW AROMATIC MACROCYCLIC METAL COMPLEX DYES AND THE SYNTHESIS THEREOF WITH ACTIVE NANO METAL POWDERS
  申请人：Olgun, Ugursoy

  公开号：EP3157927A1

  公开（公告）日：2017-04-26
• COLORING COMPOSITION, FILM, COLOR FILTER, SOLID-STATE IMAGING ELEMENT, AND IMAGE DISPLAY DEVICE
  申请人：FUJIFILM Corporation

  公开号：US20210395487A1

  公开（公告）日：2021-12-23

  Provided are a coloring composition including a colorant including a green pigment, a compound A, and a resin, in an which amount of the green pigment dissolved in 100 g of propylene glycol methyl ether acetate at 25° C. is less than 0.01 g, an amount of the compound A dissolved in 100 g of propylene glycol methyl ether acetate at 25° C. is 0.01 g or more, the coloring composition includes 0.1 to 10 parts by mass of the compound A with respect to 100 parts by mass of the green pigment, and the green pigment and the compound A satisfy a relationship of “−1.0 eV≤LUMO B −LUMO A ≤1.0 eV”; a film; a color filter; a solid-state imaging element; and an image display device. LUMO B is an energy level of a lowest unoccupied molecular orbital of the green pigment, and LUMO A is an energy level of a lowest unoccupied molecular orbital of the compound A.