N,N-bis[4-(dimethylamino)butyl]-3,4,9,10-perylenetetracarboxylic diimide | 1613576-47-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 菲及其衍生物
• 英文名称: N,N-bis[4-(dimethylamino)butyl]-3,4,9,10-perylenetetracarboxylic diimide
• 英文别名: 7,18-Bis[4-(dimethylamino)butyl]-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone；7,18-bis[4-(dimethylamino)butyl]-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
• CAS: 1613576-47-8
• 化学式: C₃₆H₃₆N₄O₄
• 分子量: 588.706
• InChiKey: KQDAKZWKXQZLSU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  44
• 可旋转键数：
  10
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  81.2
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  3,4,9,10-苝四羧酸二酐 、 4-二甲基氨基丁胺 以 N,N-二甲基甲酰胺 为溶剂， 以92%的产率得到N,N-bis[4-(dimethylamino)butyl]-3,4,9,10-perylenetetracarboxylic diimide
  参考文献：
  名称：

  Efficient Host–Guest Energy Transfer in Polycationic Cyclophane–Perylene Diimide Complexes in Water

  摘要：

  We report the self-assembly of a series of highly charged supramolecular complexes in aqueous media composed of cyclobis(4,4'-(1,4-phenylene)bispyridine-p-phenylene)tetrakis(chloride) (ExBox) and three dicationic perylene diimides (PDIs). Efficient energy transfer (ET) is observed between the host and guests. Additionally, we show that our hexacationic complexes are capable of further complexation with neutral cucurbit[7]uril (CB[7]), producing a 3-polypseudorotaxane via the self-assembly of orthogonal recognition moieties. ExBox serves as the central ring, complexing to the PDI core, while two CB[7]s behave as supramolecular stoppers, binding to the two outer quaternary ammonium motifs. The formation of the 3-polypseudorotaxane results in far superior photophysical properties of the central PDI unit relative to the binary complexes at stoichiometric ratios. Lastly, we also demonstrate the ability of our binary complexes to act as a highly selective chemosensing ensemble for the neurotransmitter melatonin.

  DOI：

  10.1021/ja5032437

文献信息

• SENSOR COMPOUNDS AND ASSOCIATED METHODS AND DEVICES
  申请人：UNIVERSITY OF UTAH RESEARCH FOUNDATION

  公开号：US20180201612A1

  公开（公告）日：2018-07-19

  Methods of detecting a non-explosive analyte can include exposing a sensor compound to a non-explosive analyte and displaying a change in the sensor compound upon exposure of the sensor compound to the non-explosive analyte. A variety of sensor compounds for detecting a target analyte, including both explosive and non-explosive analytes, is also described. Sensor devices for detecting a target analyte can include a substrate and a sensor compound positioned on the substrate in a plurality of detection zones.

  检测非爆炸性分析物的方法可以包括将传感器化合物暴露于非爆炸性分析物，并在传感器化合物暴露于非爆炸性分析物时显示传感器化合物的变化。还描述了用于检测目标分析物（包括爆炸性和非爆炸性分析物）的各种传感器化合物。用于检测目标分析物的传感器设备可以包括底板和位于底板上的传感器化合物，其位于多个检测区域中。
• Chemical self-doping of one-dimensional organic nanomaterials for high conductivity application in chemiresistive sensing gas or vapor
  申请人：University of Utah Research Foundation

  公开号：US11022592B2

  公开（公告）日：2021-06-01

  A chemiresistive vapor sensor compound for detecting target vapors can comprise a perylene-tetracarboxylic diimide (PTCDI) core according to structure (I): where R can be a morphology control group or -A′-D′, A and A′ can be independently a linking group, D and D′ can be independently a strong electron donor which transfers electrons to the PTCDI core sufficient to form an anionic PTCDI radical of the PTCDI core, and R1 to R8 can be independently a side group. A chemiresistive vapor sensor for detection of a target compound can comprise an assembly of nanofibers formed of the chemiresistive sensor compound and a pair of electrodes operatively oriented about the assembly of nanofibers to allow electrical current to pass from a first electrode in the pair of electrodes through the assembly of nanofibers and to a second electrode in the pair of electrodes.

  用于检测目标蒸气的化学电阻式蒸气传感器化合物可以包括一个符合结构（I）的过烯-四羧酸二亚胺（PTCDI）芯： 其中 R 可以是形态控制基团或-A′-D′，A 和 A′可以各自独立地是连接基团，D 和 D′可以各自独立地是强电子供体，它将电子转移到 PTCDI 核心，足以形成 PTCDI 核心的阴离子 PTCDI 基，R1 至 R8 可以各自独立地是侧基。用于检测目标化合物的化学电阻式蒸汽传感器可包括由化学电阻式传感器化合物形成的纳米纤维组件，以及围绕纳米纤维组件可操作地定向的一对电极，以允许电流从一对电极中的第一电极通过纳米纤维组件并到达一对电极中的第二电极。
• Detecting Compounds in Airborne Particles Using Ion Exchange
  申请人：University of Utah Research Foundation

  公开号：US20210341373A1

  公开（公告）日：2021-11-04

  A sensor to detect solid particles of a target salt can include a support substrate, an adsorption layer, a sensing layer oriented between the support substrate and the adsorption layer, and an electrode pair in contact with the sensing layer and separated by the sensing layer. The adsorption layer can include an ion exchange medium formed of a first porous structured material functionalized with basic or acidic functional groups. The basic or acidic functional groups can remove an acid or base component from the target salt to form a free base or free acid, respectively, of the target salt. The sensing layer can include a second porous structured material functionalized to detect the free base or acid of the target salt by a change in conductivity.
• [EN] SENSOR COMPOUNDS AND ASSOCIATED METHODS AND DEVICES<br/>[FR] COMPOSÉS DE DÉTECTION ET PROCÉDÉS ET DISPOSITIFS ASSOCIÉS
  申请人：UNIV UTAH RES FOUND

  公开号：WO2017008074A1

  公开（公告）日：2017-01-12

  Methods of detecting a non-explosive analyte can include exposing a sensor compound to a non-explosive analyte and displaying a change in the sensor compound upon exposure of the sensor compound to the non-explosive analyte. A variety of sensor compounds for detecting a target analyte, including both explosive and non-explosive analytes, is also described. Sensor devices for detecting a target analyte can include a substrate and a sensor compound positioned on the substrate in a plurality of detection zones.
• [EN] CHEMICAL SELF-DOPING OF ONE-DIMENSIONAL ORGANIC NANOMATERIALS FOR HIGH CONDUCTIVITY APPLICATION IN CHEMIRESISTIVE SENSING GAS OR VAPOR<br/>[FR] AUTODOPAGE CHIMIQUE DE NANOMATÉRIAUX ORGANIQUES UNIDIMENSIONNELS DESTINÉS À UNE APPLICATION DE HAUTE CONDUCTIVITÉ DANS UN GAZ OU UNE VAPEUR DE DÉTECTION CHIMIORÉSISTIVE
  申请人：UNIV UTAH RES FOUND

  公开号：WO2017142609A2

  公开（公告）日：2017-08-24

  A chemiresi stive vapor sensor compound for detecting target vapors can comprise a perylene-tetracarboxylic diimide (PTCDI) core according to structure (I), where R can be a morphology control group or -A'-D', A and A' can be independently a linking group, D and D' can be independently a strong electron donor which transfers electrons to the PTCDI core sufficient to form an anionic PTCDI radical of the PTCDI core, and Rl to R8 can be independently a side group. A chemiresi stive vapor sensor (100) for detection of a target compound can comprise an assembly of nanofibers (105) formed of the chemiresi stive sensor compound and a pair of electrodes (150A, 150B) operatively oriented about the assembly of nanofibers (105) to allow electrical current to pass from a first electrode in the pair of electrodes (150A, 150B) through the assembly of nanofibers (105) and to a second electrode in the pair of electrodes.