4,4,4-Trifluoro-1-[1-methyl-4-nitro-5-(trifluoromethyl)pyrazol-3-yl]butane-1,3-dione

• 分子结构分类: 有机化合物 - 有机1,3-偶极化合物 - 烯丙基型1,3-偶极有机化合物
• 英文名称: 4,4,4-Trifluoro-1-[1-methyl-4-nitro-5-(trifluoromethyl)pyrazol-3-yl]butane-1,3-dione
• 英文别名: 4,4,4-trifluoro-1-[1-methyl-4-nitro-5-(trifluoromethyl)pyrazol-3-yl]butane-1,3-dione
• 化学式: C9H5F6N3O4
• 分子量: 333.14
• InChiKey: RWCRXEWATOHYLX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  97.8
• 氢给体数：
  0
• 氢受体数：
  11

文献信息

• [EN] RARE EARTH METAL ION COMPLEX, LUMINESCENT COMPOSITE MATERIAL, LIGHT EMITTING DEVICE, AND USE<br/>[FR] COMPLEXE D'ION DE MÉTAL DES TERRES RARES, MATÉRIAU COMPOSITE LUMINESCENT, DISPOSITIF ÉLECTROLUMINESCENT ET UTILISATION
  申请人：ORGANIC LIGHTING SOLUTIONS UG

  公开号：WO2014104917A1

  公开（公告）日：2014-07-03

  The invention relates to a rare earth metal ion complex for luminescent composite (3) material for wavelength conversion. The complex has the following formula (1): [Ln(L1)3L2], wherein Ln represents a trivalent rare earth metal ion; L2 represents a bidentate ligand containing nitro-gen; and L1 represents a diketonate ligand derivative having the following formula (2) wherein R1 represents an alkyl group, a fluoroalkyl group, or a substituted or an unsubstituted aryl group; R2 represents a hydrogen atom, an alkyl group, a fluoroalkyl group, a substituted or an unsubstituted aryl group, a halogen atom, or a NO2 group; R3 represents an alkyl group, a substituted or unsubstituted aryl group, a halogen atom, or a NO2 group; and RF represents an alkyl group substituted with at least one fluorine atom.