dicyanobenzimidazolone | 889964-08-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: dicyanobenzimidazolone
• 英文别名: 1H-1,3-Benzimidazole-5,6-dicarbonitrile, 2,3-dihydro-2-oxo-；2-oxo-1,3-dihydrobenzimidazole-5,6-dicarbonitrile
• CAS: 889964-08-3
• 化学式: C₉H₄N₄O
• mdl: MFCD06618227
• 分子量: 184.157
• InChiKey: OYVYVXHJEGGNEO-UHFFFAOYSA-N

物化性质

• 沸点：
  269.2±40.0 °C(Predicted)
• 密度：
  1.53±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0
• 重原子数：
  14
• 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：
  88.7
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  dicyanobenzimidazolone 在 sodium hydride 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 cobalt(II) bromide 作用下， 以 paraffin oil (nujol) 、 戊醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 12.0h， 生成
  参考文献：
  名称：

  PHTHALOCYANINE COMPOUND, PREPARATION METHOD THEREFOR, AND COLORING COMPOSITION INCLUDING SAID PHTHALOCYANINE COMPOUND

  摘要：

  公开号：

  EP2465860B1
• 作为产物：
  描述：

  N,N'-羰基二咪唑 、 4,5二胺基邻苯二氰 以 水 、 乙腈 为溶剂， 反应 5.0h， 以90%的产率得到dicyanobenzimidazolone
  参考文献：
  名称：

  蛍光標識剤、光線力学治療剤およびフタロシアニン

  摘要：

  在800纳米以上的波长范围内，提供具有适用于荧光标记剂和光动力治疗剂的荧光强度、耐光性和优良一重态氧发生能力的邻苯二酰亚胺类化合物的特性。通过在下述式中表示的磷化合物的磷原子上配位邻苯二酰亚胺类化合物而得到的含磷邻苯二酰亚胺类化合物的盐，以及含有该含磷邻苯二酰亚胺类化合物盐的荧光标记剂和光动力治疗剂。R5O-P-OR6（R5和R6是H、脂肪族烃基、-P(=O)R7R8、-C(=O)R9、-S(=O)2R10或-SiR11R12R13；R7和R8是H、OH、脂肪族烃基、芳香族烃基、Alkoxy基或Aryloxy基；R9是H、脂肪族烃基或芳香族烃基；R10是OH、脂肪族烃基或芳香族烃基；R11〜R13是脂肪族烃基或芳香族烃基。）【选择图】无

  公开号：

  JP2021063036A

文献信息

• ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME
  申请人：LG Display Co., Ltd

  公开号：US20210050527A1

  公开（公告）日：2021-02-18

  The present disclosure provides an organic compound of the following formula and an organic light emitting diode and an OLED device including the same.

  本公开提供了以下式的有机化合物，以及包括该化合物的有机发光二极管和OLED器件。
• PHTHALOCYANINE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND COLORED COMPOSITION CONTAINING THE PHTHALOCYANINE COMPOUND
  申请人：DIC Corporation

  公开号：EP1870438B8

  公开（公告）日：2011-10-05
• PHTHALOCYANINE COMPOUND AND METHOD FOR PRODUCING THE SAME, AND COLORING COMPOSITION CONTAINING THE PHTHALOCYANINE COMPOUND
  申请人：Nagata Yoshiaki

  公开号：US20090018328A1

  公开（公告）日：2009-01-15

  To provide a phthalocyanine compound represented by the following general formula (1), which is halogen-free and has green hue, and also has resistance to an organic solvent and an acid: in the above general formula (1), M represents a divalent to tetravalent metal atom or two hydrogen atoms, and rings A 1 , A 2 , A 3 and A 4 each independently represents a benzene ring or a structure represented by the above general formula (2), provided that at least one of rings A 1 , A 2 , A 3 and A 4 is a structure represented by the general formula (2) and, in the above general formula (2), R represents a hydrogen atom, an alkyl group having 1 to 4 carbon atoms, a phenyl group, a tolyl group, or a xylyl group.
• PHTHALOCYANINE COMPOUND AND PRODUCTION METHOD THEREFOR, AND COLORING COMPOSITION CONTAINING THE PHTHALOCYANINE COMPOUND
  申请人：Kondou Hitoshi

  公开号：US20120232194A1

  公开（公告）日：2012-09-13

  Provided is a phthalocyanine compound which is halogen-free and which has a green hue, excellent resistance to organic solvents and acids, and high chroma. Also provided are a metal-free phthalocyanine compound or a metal phthalocyanine compound represented by specified general formula (1-1) or (1-2) and having a N,N′-disubstituted imidazolone structure or piperazinedione structure introduced therein, and a coloring composition including the compound and a synthetic resin. The phthalocyanine compound of the present invention exhibits a clear green color and is halogen-free, and is thus useful as a clear green pigment for coloring materials such as a coating material, plastic, a printing ink, rubber, leather, textile printing, a color filter, a jet ink, a heat transfer ink, etc.
• US7799911B2
  申请人：——

  公开号：US7799911B2

  公开（公告）日：2010-09-21