4-carboxy-4'-N,N-diethylaminocarbonyl-2,2'-bipyridine | 868051-73-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 4-carboxy-4'-N,N-diethylaminocarbonyl-2,2'-bipyridine
• 英文别名: 2,2'-bipyridine-4,4'-dicarboxylic acid, N,N diethyl amide；2-[4-(diethylcarbamoyl)pyridin-2-yl]pyridine-4-carboxylic acid
• CAS: 868051-73-4
• 化学式: C₁₆H₁₇N₃O₃
• 分子量: 299.329
• InChiKey: XDLFZMXFLKMOHZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  22
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  83.4
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  二乙胺 、 2,2'-bipyridine-4,4'-dicarboxylic acid chloride 在 4-二甲氨基吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 24.0h， 生成 4-carboxy-4'-N,N-diethylaminocarbonyl-2,2'-bipyridine
  参考文献：
  名称：

  DYE AND DYE-SENSITIZED SOLAR CELL

  摘要：

  一种新型染料，当用于染料敏化太阳能电池时具有高转换效率、优异的耐候性和耐热性，以及包含该染料的染料敏化太阳能电池。该染料由以下化学式（1）表示： ML1L2X1X2 其中，M是周期表长式中8至10族中的任一元素，L1和L2分别是由特定的双吡啶组成的双齿配体，X1和X2分别是单价原子团或单齿配体。

  公开号：

  EP1767588A1

文献信息

• Method of use of imidazolium cations
  申请人：The Rockefeller University

  公开号：US06087510A1

  公开（公告）日：2000-07-11

  Methods of preparation of dyed textiles, fluorescent polymer matrices, fluorescent clonal markers, non-lineal optical polymers and diagnostic imaging agents are described using compounds with the general formula ##STR1## wherein A represents the atomic group necessary to form a heteroaromatic ring, wherein R may be a variety of; wherein P or Q are optional substituents, each independently a substituent selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halo, lower alkylamino, amino, nitro, or carboxy, or P and Q together represent the atomic group necessary to form a heteroaromatic ring, wherein R' may be a variety of substituents; C is an optional substituent which represents the atomic group necessary to form an aromatic or heteroaromatic ring, wherein R"" may be a variety of substituents; R" is hydrogen, a lower alkyl or aryl group, or together with R'" and the nitrogen atom to which it is attached, form a heterocyclic ring having from 5 to 7 members, which may optionally contain a sulfur, oxygen, silicon, selenium or an additional nitrogen atom, said ring optionally substituted with at least one lower alkyl group; R'" is a lower alkyl or aryl group, or together with R" and the nitrogen atom to which it is attached, form a heterocyclic ring having from 5 to 7 members, which may optionally contain a sulfur, oxygen, silicon, selenium or an additional nitrogen atom, said ring optionally substituted with at least one lower alkyl group; and X is an anion.

  本文描述了使用具有一般式##STR1##化合物制备染色纺织品、荧光聚合物基质、荧光克隆标记物、非线性光学聚合物和诊断成像剂的方法。其中A代表形成杂环芳香环所必需的原子团，R可以是多种取代基；P或Q为可选的取代基，每个独立地选自芳基、杂芳基、低碳烷基、羟基、卤素、低碳烷基氨基、氨基、硝基或羧基的取代基，或P和Q一起代表形成杂环芳香环所必需的原子团，其中R'可以是多种取代基；C是可选的取代基，代表形成芳香或杂芳香环所必需的原子团，其中R"可以是多种取代基；R"是氢、低碳烷基或芳基基团，或者与R'"和所连接的氮原子一起形成具有5至7个成员的杂环，该杂环可以选择性地含有硫、氧、硅、硒或另一个氮原子，该环可选地取代至少一个低碳烷基基团；R'"是低碳烷基或芳基基团，或者与R"和所连接的氮原子一起形成具有5至7个成员的杂环，该杂环可以选择性地含有硫、氧、硅、硒或另一个氮原子，该环可选地取代至少一个低碳烷基基团；X是阴离子。
• Imidazolium cations, processes for their preparation, and uses therefor
  申请人：The Rockefeller University

  公开号：US05874587A1

  公开（公告）日：1999-02-23

  Novel imidazolium compounds of the formula ##STR1## wherein A represents the atomic group necessary to form a heteroaromatic ring, which may be optionally substituted by one or more R substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substitutents; B is an optional substituent which represents the atomic group necessary to form a heteroaromatic ring or a double or triple carbon-nitrogen bond, which may optionally be substituted by one or more R' substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substitutents; C is an optional substituent which represents the atomic group necessary to form an aromatic or heteroaromatic ring, which may optionally be substituted by one or more R"" substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substituents; R" and R'" are each independently a lower alkyl or aryl group, or together with the nitrogen atom to which they are attached, form a heterocyclic ring having from 5 to 7 members, which may optionally contain a sulfur, oxygen, silicon, selenium or an additional nitrogen atom; and X is an anion; are useful in a variety of industrial and medical applications.

  式子为##STR1##的新型咪唑化合物，其中A代表形成杂环芳香环所需的原子基团，该基团可以选择性地被一个或多个R取代，所述R取代基团选自芳基、杂芳基、较低的烷基、羟基、卤素或羧基取代基团；B是一个可选取代基团，代表形成杂环芳香环或双或三重碳氮键所需的原子基团，该基团可以选择性地被一个或多个R' 取代，所述R' 取代基团选自芳基、杂芳基、较低的烷基、羟基、卤素或羧基取代基团；C是一个可选取代基团，代表形成芳香或杂芳香环所需的原子基团，该基团可以选择性地被一个或多个R"" 取代，所述R"" 取代基团选自芳基、杂芳基、较低的烷基、羟基、卤素或羧基取代基团；R"和R'"各自独立地是较低的烷基或芳基基团，或者与它们所连接的氮原子一起形成一个含有5到7个成员的杂环，该杂环可以选择性地包含硫、氧、硅、硒或另一个氮原子；X是一个阴离子。这些化合物在各种工业和医疗应用中有用。
• Imidazolium cations and uses therefor
  申请人：The Rockefeller University

  公开号：US06187928B1

  公开（公告）日：2001-02-13

  Novel imidazolium compounds of the formula wherein A represents the atomic group necessary to form a heteroaromatic ring, which may be optionally substituted by one or more R substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substitutents; B is an optional substituent which represents the atomic group necessary to form a heteroaromatic ring or a double or triple carbon-nitrogen bond, which may optionally be substituted by one or more R′ substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substitutents; C is an optional substituent which represents the atomic group necessary to form an aromatic or heteroaromatic ring, which may optionally be substituted by one or more R″″ substituents selected from the group consisting of aryl, heteroaryl, lower alkyl, hydroxy, halide, or carboxy substituents; R″ and R′″ are each independently a lower alkyl or aryl group, or together with the nitrogen atom to which they are attached, form a heterocyclic ring having from 5 to 7 members, which may optionally contain a sulfur, oxygen, silicon, selenium or an additional nitrogen atom; and X is an anion; are useful in a variety of industrial and medical applications.

  化合物的式子为：其中A代表形成杂环芳香环所需的原子团，可以选择性地由苯基、杂芳基、低碳基、羟基、卤素或羧基基团中的一个或多个R基团取代；B是可选的取代基，代表形成杂环芳香环或双或三重碳-氮键所需的原子团，可以选择性地由苯基、杂芳基、低碳基、羟基、卤素或羧基基团中的一个或多个R'基团取代；C是可选的取代基，代表形成芳香或杂芳香环所需的原子团，可以选择性地由苯基、杂芳基、低碳基、羟基、卤素或羧基基团中的一个或多个R''''基团取代；R''和R''''各自独立地是低碳基或苯基，或者与它们所连接的氮原子一起形成一个含有5至7个成员的杂环，可以选择性地包含硫、氧、硅、硒或另一个氮原子；X是一个阴离子；这些化合物在各种工业和医疗应用中非常有用。
• Dye and Dye-Sensitized Solar Cell
  申请人：Wang Yong

  公开号：US20070209695A1

  公开（公告）日：2007-09-13

  A novel dye which has high conversion efficiency, excellent weatherability and heat resistance when it is used in a dye-sensitized solar cell and a dye-sensitized solar cell comprising this dye. This dye is represented by the following formula (1): ML 1 L 2 X 1 X 2 (1) wherein M is an element of any one of the groups 8 to 10 of the long form of the periodic table, L 1 and L 2 are each independently a bidentate ligand composed of a specific bipyridine, and X 1 and X 2 are each independently a monovalent atomic group or unidentate ligand.