1-Benzyl-2-[3-(3,3-dibenzyl-5-chloro-1-methylindol-1-ium-2-yl)prop-2-enylidene]-3-methyl-1-prop-2-enylbenzo[e]indole

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-Benzyl-2-[3-(3,3-dibenzyl-5-chloro-1-methylindol-1-ium-2-yl)prop-2-enylidene]-3-methyl-1-prop-2-enylbenzo[e]indole
• 英文别名: 1-benzyl-2-[3-(3,3-dibenzyl-5-chloro-1-methylindol-1-ium-2-yl)prop-2-enylidene]-3-methyl-1-prop-2-enylbenzo[e]indole
• 化学式: C49H44ClN2+
• 分子量: 696.3
• InChiKey: PQMSFLKOROJMMF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.3
• 重原子数：
  52
• 可旋转键数：
  10
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.16
• 拓扑面积：
  6.2
• 氢给体数：
  0
• 氢受体数：
  1

文献信息

• OPTICAL RECORDING MATERIAL AND OPTICAL RECORDING MEDIA
  申请人：Shinkai Masahiro

  公开号：US20090149660A1

  公开（公告）日：2009-06-11

  An optical recording medium provided with a recording layer that comprises a cation represented by the following general formula (1) and a chelate compound of an azo compound represented by the following general formula (2) and a metal. In the formulas, R 1 -R 4 each independently represent a monovalent group represented by Chemical Formula (10) below or other groups, R 5 and R 6 each independently represent an optionally substituted alkyl group or other groups, R 7 represents a hydrogen atom or other groups, Q 1 and Q 2 each independently represent a group that forms an optionally substituted benzene ring or other groups, at least one from among R 1 -R 4 is a monovalent group represented by Chemical Formula ( 10 ) below, [Chemical Formula 2] [CH 2 ═CH—CH 2   (10) and at least one of Ar 1 and Ar 2 is an aryl or other group having a substituent capable of coordinating with a metal atom.