5-异硫氰基-1,10-菲罗啉 | 75618-99-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 菲咯啉
• 中文名称: 5-异硫氰基-1,10-菲罗啉
• 英文名称: 5-isothiocyanato-1,10-phenanthroline
• CAS: 75618-99-4
• 化学式: C₁₃H₇N₃S
• 分子量: 237.285
• InChiKey: TZAFRFYNRUUPFS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  70.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  5-异硫氰基-1,10-菲罗啉 、 硅烷偶联剂 KH-540 以 二氯甲烷 、 正戊烷 为溶剂， 反应 0.17h， 以100%的产率得到N-(1,10-phenanthrolin-5-yl)-N'-(3-trimethoxysilylpropyl)thiourea
  参考文献：
  名称：

  Synthesis of 5-isothiocyanato-1,10-phenanthroline

  摘要：

  Reduction of 5-nitro-1,10-phenanthroline with hydrogen over Pd/C, followed by the treatment of 1,10-phenanthrolin-5-amine with thiophosgene in the presence of sodium acetate, gave 5-isothiocyanato-1,10-phenanthroline which is a thermally stable highly reactive ligand capable of quantitatively forming covalently bonded nanohybrid structures in a system transition metal complex-silica under mild conditions.

  DOI：

  10.1134/s1070428006040129
• 作为产物：
  描述：

  5-硝基-1,10-菲咯啉 在 palladium on activated charcoal 氢气 、 sodium acetate 作用下， 以 N,N-二甲基乙酰胺 、 水 、 丙酮 为溶剂， 反应 48.08h， 生成 5-异硫氰基-1,10-菲罗啉
  参考文献：
  名称：

  Synthesis of 5-isothiocyanato-1,10-phenanthroline

  摘要：

  Reduction of 5-nitro-1,10-phenanthroline with hydrogen over Pd/C, followed by the treatment of 1,10-phenanthrolin-5-amine with thiophosgene in the presence of sodium acetate, gave 5-isothiocyanato-1,10-phenanthroline which is a thermally stable highly reactive ligand capable of quantitatively forming covalently bonded nanohybrid structures in a system transition metal complex-silica under mild conditions.

  DOI：

  10.1134/s1070428006040129

文献信息

• [EN] LUMINESCENT GOLD(III) COMPOUNDS CONTAINING BIDENTATE LIGAND FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION<br/>[FR] COMPOSÉS AURIQUES (AU TRIVALENT) LUMINESCENTS CONTENTANT UN LIGAND BIDENTATE POUR DISPOSITIFS ÉLECTROLUMINESCENTS ORGANIQUES ET LEUR PRÉPARATION
  申请人：UNIV HONG KONG

  公开号：WO2011006353A1

  公开（公告）日：2011-01-20

  Embodiments of the invention are directed to luminescent gold(III) compounds contains a bidentate ligand with at least one strong σ-donating group, a method of preparation of these compounds and the use of these compounds in organic light emitting devices.. The gold (III) compounds have the chemical structure: Formular (I) wherein: X Is a nitrogen atom; Y is selected from a carbon or a nitrogen atom; A-B is a substituted or unsubstituted cyclometalating ligand (for Y=C) or diimine ligand (for Y=N); where A and B are cyclic structure derivatives; R 1and R2 are optionally substituted carbon donor ligands attached to the gold atom, with the proviso that R1 and R2 are not -CH3, -CH2SiMe3, mesityl, pentaflurophenyl, -CH2C(O)R', -CH(R)SO2CH(R)-, -C6H4N=NC6H5, and wherein R1 and R2 can optionally be combined into a bidentate ligand; and n is greater or equal to zero.

  本发明的实施例涉及含有至少一个强σ-供体基团的双齿配体的发光金(III)化合物，以及制备这些化合物的方法和将这些化合物用于有机发光器件的用途。金(III)化合物具有化学结构：公式(I)，其中：X是氮原子；Y选择自碳或氮原子；A-B是取代或未取代的环金属配体(Y=C)或二亚胺配体(Y=N)，其中A和B是环结构衍生物；R1和R2是附着在金原子上的可选取代碳供体配体，但须注意R1和R2不是-CH3、-CH2SiMe3、mesityl、pentaflurophenyl、-CH2C(O)R'、-CH(R)SO2CH(R)-、-C6H4N=NC6H5，其中R1和R2可以选择性地结合成为双齿配体；n大于或等于零。
• ENZYMATIC NANOSENSOR COMPOSITIONS AND METHODS
  申请人：Northeastern University

  公开号：EP2823051A2

  公开（公告）日：2015-01-14
• LUMINESCENT GOLD(III) COMPOUNDS CONTAINING BIDENTATE LIGAND FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION
  申请人：Yam Vivian Wing-Wah

  公开号：US20110012093A1

  公开（公告）日：2011-01-20

  Embodiments of the invention are directed to luminescent gold(III) compounds contains a bidentate ligand with at least one strong σ-donating group, a method of preparation of these compounds and the use of these compounds in organic light emitting devices. The gold(III) compounds have the chemical structure: wherein: X is a nitrogen atom; Y is selected from a carbon or a nitrogen atom; A-B is a substituted or unsubstituted cyclometalating ligand (for Y═C) or diimine ligand (for Y═N); where A and B are cyclic structure derivatives; R 1 and R 2 are optionally substituted carbon donor ligands attached to the gold atom, with the proviso that R 1 and R 2 are not —CH 3 , —CH 2 SiMe 3 , mesityl, pentafluorophenyl, —CH 2 C(O)R′, —CH(R)SO 2 CH(R)—, —C 6 H 4 N═NC 6 H 5 , and wherein R 1 and R 2 can optionally be combined into a bidentate ligand; and n is greater or equal to zero.
• Enzymatic Nanosensor Compositions and Methods
  申请人：Northeastern University

  公开号：US20150030544A1

  公开（公告）日：2015-01-29

  Disclosed herein are compositions including a nanosensor that is sensitive to an analyte such that the nanosensor emits a fluorescent signal upon detecting the analyte, and a catalytic agent that catalyzes a reaction in which a target substrate is converted into one or more products, such that at least one of the one or more products is the analyte. In addition, methods of using the nanosensor-catalytic agent compositions to detect a target substrate are disclosed.
• US8372977B2
  申请人：——

  公开号：US8372977B2

  公开（公告）日：2013-02-12