5-[[5-Cyano-4-methyl-6-(4-methyl-3-sulfoanilino)pyridin-2-yl]amino]-2-methylbenzenesulfonic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 5-[[5-Cyano-4-methyl-6-(4-methyl-3-sulfoanilino)pyridin-2-yl]amino]-2-methylbenzenesulfonic acid
• 英文别名: 5-[[5-cyano-4-methyl-6-(4-methyl-3-sulfoanilino)pyridin-2-yl]amino]-2-methylbenzenesulfonic acid
• 化学式: C₂₁H₂₀N₄O₆S₂
• 分子量: 488.5
• InChiKey: PPTIVIJVCVWLJX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  33
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  186
• 氢给体数：
  4
• 氢受体数：
  10

文献信息

• AZO COMPOUND, AQUEOUS SOLUTION, INK COMPOSITION, INK FOR INKJET RECORDING, INKJET RECORDING METHOD, INK CARTRIDGE FOR INKJET RECORDING, AND INKJET RECORDED MATERIAL
  申请人：FUJIFILM Corporation

  公开号：US20140084578A1

  公开（公告）日：2014-03-27

  There is provided a compound represented by the following formula (1): wherein each of R 1a to R 1k independently represents a hydrogen atom or a monovalent substituent, the substituents may combine with each other to form a ring, each of M 1a and M 1b independently represents a hydrogen atom or a monovalent counter cation, Y 1 represents a nitrogen atom or a carbon atom having a hydrogen atom or monovalent substituent, A 1 represents an aromatic group, and the aromatic group represented by A 1 may contain a heteroatom or may have a substituent.