2-[[5-Acetamido-2-methoxy-4-[[2-sulfo-4-(3-sulfooxypropyl)phenyl]diazenyl]phenyl]diazenyl]-3,5-diamino-4-[(4-methylphenyl)diazenyl]-6-phenyldiazenylbenzoic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• 英文名称: 2-[[5-Acetamido-2-methoxy-4-[[2-sulfo-4-(3-sulfooxypropyl)phenyl]diazenyl]phenyl]diazenyl]-3,5-diamino-4-[(4-methylphenyl)diazenyl]-6-phenyldiazenylbenzoic acid
• 英文别名: 2-[[5-acetamido-2-methoxy-4-[[2-sulfo-4-(3-sulfooxypropyl)phenyl]diazenyl]phenyl]diazenyl]-3,5-diamino-4-[(4-methylphenyl)diazenyl]-6-phenyldiazenylbenzoic acid
• 化学式: C₃₈H₃₇N₁₁O₁₁S₂
• 分子量: 887.9
• InChiKey: XNOCWBLVZPSDRF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  62
• 可旋转键数：
  17
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  361
• 氢给体数：
  6
• 氢受体数：
  21

文献信息

• Mixtures of Reactive Dyes and Their Use
  申请人：Roentgen Georg

  公开号：US20140173835A1

  公开（公告）日：2014-06-26

  Dye mixtures comprising at least one reactive dye of the formula (1) together with at least one reactive dye of the formula (2), wherein one of the radicals A and B denotes NH 2 , and the other one of the radicals A and B denotes OH, D is a benzene or naphthalene radical, R 1 is hydrogen, hydroxy, sulfo, C 1 -C 4 alkyl or C 1 -C 4 alkoxy unsubstituted or substituted in the alkyl moiety by hydroxy or by sulfato, R 2 is hydrogen, C 1 -C 4 alkyl, C 1 -C 4 alkoxy, C 2 -C 4 alkanoylamino or ureido, R 3 is C 1 -C 4 alkyl, (R 4 ) 0-2 denotes 0 to 2 identical or different substituents selected from the group C 1 -C 4 alkyl, C 1 -C 4 alkoxy or sulfo, X1 is halogen, 3-carboxypyridin-1-yl or 3-carbamoylpyridin-1-yl, Y 1 , Y 2 , Y 3 , Y 4 and Y 5 are each independently of the other vinyl or a radical —CH 2 CH 2 —U and U is a group removable under alkaline conditions, h, k, l, m and n are each independently of the other the number 0, 1 or 2, and p and q are each independently of the other the number 0 or 1, are suitable for dyeing and printing cellulosic or nitrogen-containing fibre materials.