7,22-Dimethyl-7,22-diazadecacyclo[14.14.2.22,5.217,20.03,12.04,9.013,31.018,27.019,24.028,32]hexatriaconta-1(31),2,4,9,11,13,15,17(34),18(27),19(24),20(33),25,28(32),29,35-pentadecaene-6,8,21,23-tetrone | 861411-09-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 7,22-Dimethyl-7,22-diazadecacyclo[14.14.2.22,5.217,20.03,12.04,9.013,31.018,27.019,24.028,32]hexatriaconta-1(31),2,4,9,11,13,15,17(34),18(27),19(24),20(33),25,28(32),29,35-pentadecaene-6,8,21,23-tetrone
• CAS: 861411-09-8
• 化学式: C₃₆H₁₈N₂O₄
• 分子量: 542.55
• InChiKey: WURVVBVAIXZCKS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  42
• 可旋转键数：
  0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  74.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  6-溴-2-甲基-1H-苯并[de]异喹啉-1,3(2H)-二酮 在 potassium tert-butylate 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 2-甲基丁醇 、 二乙二醇二甲醚 为溶剂， 反应 2.25h， 以73%的产率得到7,22-Dimethyl-7,22-diazadecacyclo[14.14.2.22,5.217,20.03,12.04,9.013,31.018,27.019,24.028,32]hexatriaconta-1(31),2,4,9,11,13,15,17(34),18(27),19(24),20(33),25,28(32),29,35-pentadecaene-6,8,21,23-tetrone
  参考文献：
  名称：

  [DE] VERFAHREN ZUR HERSTELLUNG VON TERRYLEN-3,4:11,12-TETRACARBONSÄUREDIIMIDEN DURCH DIREKTSYNTHESE
  [EN] METHOD FOR THE PRODUCTION OF TERYLENE-3,4:11,12-TETRACARBOXYDIIMIDES BY DIRECT SYNTHESIS
  [FR] PROCEDE DE PRODUCTION DE DIIMIDES DE TERYLENE-3,4:11,12-ACIDE TETRACARBOXYLIQUE PAR SYNTHESE DIRECTE

  摘要：

  制备Terrylen-3,4:11,12-四羧酸二亚胺（I）的方法，其中变量的含义如下：R，R'独立地表示氢；可选择地取代的烷基或环烷基，芳基或杂环烷基；R¹表示氢或烷基；R²表示氢；烷基；可选择地取代的芳基或杂环烷基，方法是在碱稳定、高沸点的有机溶剂和含有碱金属或碱土金属的碱的存在下，将Perylen-3,4-二羧酸亚胺（II）与Naphthalin-1,8-二羧酸亚胺（III）在X表示氢、溴或氯的情况下进行反应。

  公开号：

  WO2005070895A1

文献信息

• LIQUID CRYSTALLINE RYLENE TETRACARBOXYLIC ACID DERIVATIVES AND USE THEREOF
  申请人：Koenemann Martin

  公开号：US20110042651A1

  公开（公告）日：2011-02-24

  The present invention relates to liquid-crystalline rylenetetracarboxylic acid derivatives, to processes for their preparation and to their use as n-type organic semiconductors for producing organic field-effect transistors and solar cells.

  本发明涉及液晶芳纶四羧酸衍生物，其制备方法以及作为n型有机半导体用于制造有机场效应晶体管和太阳能电池的用途。
• ORGANIC COMPOUND AND PHOTOVOLTAIC DEVICE COMPRISING THE SAME
  申请人：KHOKHLOV Pavel

  公开号：US20120227802A1

  公开（公告）日：2012-09-13

  The present invention provides a organic compound of the general structural formula 1 and photovoltaic device and photovoltaic layer comprising thereof Said organic compound forms rod-like supramolecules and absorbs electromagnetic radiation in at least one predetermined spectral subrange within a wavelength range from 400 to 3000 nm with excitation of electron-hole pairs. The polycyclic core Cor 1 , the bridging group B, and the polycyclic core Cor 2 form a molecular system selected from the list comprising donor-bridge-acceptor-bridge-donor and acceptor-bridge-donor-bridge-acceptor in which a dissociation of excited electron-hole pairs is carried out. A solution of the organic compound or its salt forms a solid photovoltaic layer on a substrate.

  本发明提供了一种通用结构式1的有机化合物，以及包含该化合物的光伏器件和光伏层。所述有机化合物形成棒状超分子，并在波长范围从400到3000纳米内的至少一个预定光谱子范围内吸收电磁辐射，激发电子空穴对。多环核心Cor1、桥接基团B和多环核心Cor2形成从供体-桥接-受体-桥接-供体和受体-桥接-供体-桥接-受体的分子系统中选择的分子系统，其中激发的电子空穴对的解离被执行。该有机化合物或其盐的溶液在基底上形成固体光伏层。
• Terrylene and Quaterrylene Derivatives
  申请人：Pschirer Neil Gregory

  公开号：US20080255357A1

  公开（公告）日：2008-10-16

  Rylene derivatives of the general formula I in which the variables are each defined as follows: X are joined to one another with formation of a six-membered ring to give a radical of the formula (a), (b) or (c) are both a —COOM radical; are both hydrogen or one of the two radicals is hydrogen and the other radical is halogen or a radical of the formula (d) Y are joined to one another with formation of a six-membered ring to give a radical of the formula (a) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or together are a radical of the formula (a), (b) or (c); are joined to one another with formation of a six-membered ring to give a radical of the formula (b) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical or together are a radical of the formula (c); are joined to one another with formation of a six-membered ring to give a radical of the formula (c) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical or together are a radical of the formula (c) which may be arranged in the cis or trans position to the other (c) radical; are both a —COOM radical when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical, M being different from hydrogen in the case that one X radical is a radical of the formula (d); are both hydrogen or one of the two radicals is hydrogen and the other radical is halogen or a radical of the formula (d) when both X radicals are hydrogen or one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d); R are identical or different radicals: substituted or unsubstituted aryloxy, arylthio, hetaryloxy or hetarylthio; R′ is hydrogen; substituted or unsubstituted alkyl, cycloalkyl, aryl or hetaryl; A are each independently substituted or unsubstituted phenylene, naphthylene or pyridylene; M is hydrogen, ammonium or alkali metal cation; R″ are each independently hydrogen, alkyl, cycloalkyl, aryl or hetaryl, or are joined together with formation of a 5- to 7-membered, fused or unfused and substituted or unsubstituted ring comprising the two oxygen atoms and also the boron atom; R 1 is hydrogen or alkyl, where the R 1 radicals may be the same or different when they occur more than once; R 2 , R 3 are each independently hydrogen; substituted or unsubstituted alkyl, aryl or hetaryl; m is 1 or 2; n is from 3 to 6 where m=1; is from 2 to 8 where m=2, and mixtures thereof.
• TERRYLENE AND QUATERRYLENE DERIVATIVES
  申请人：Pschirer Neil Gregory

  公开号：US20100317876A1

  公开（公告）日：2010-12-16

  Rylene derivatives of the general formula I in which the variables are each defined as follows: X are joined to one another with formation of a six-membered ring to give a radical of the formula (a), (b) or (c) are both a —COOM radical; are both hydrogen or one of the two radicals is hydrogen and the other radical is halogen or a radical of the formula (d) Y are joined to one another with formation of a six-membered ring to give a radical of the formula (a) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or together are a radical of the formula (a), (b) or (c); are joined to one another with formation of a six-membered ring to give a radical of the formula (b) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical or together are a radical of the formula (c); are joined to one another with formation of a six-membered ring to give a radical of the formula (c) when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical or together are a radical of the formula (c) which may be arranged in the cis or trans position to the other (c) radical; are both a —COOM radical when one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d) or when both X radicals are hydrogen or a —COOM radical, M being different from hydrogen in the case that one X radical is a radical of the formula (d); are both hydrogen or one of the two radicals is hydrogen and the other radical is halogen or a radical of the formula (d) when both X radicals are hydrogen or one of the two X radicals is hydrogen and the other X radical is halogen or a radical of the formula (d); R are identical or different radicals: substituted or unsubstituted aryloxy, arylthio, hetaryloxy or hetarylthio; R′ is hydrogen; substituted or unsubstituted alkyl, cycloalkyl, aryl or hetaryl; A are each independently substituted or unsubstituted phenylene, naphthylene or pyridylene; M is hydrogen, ammonium or alkali metal cation; R″ are each independently hydrogen, alkyl, cycloalkyl, aryl or hetaryl, or are joined together with formation of a 5- to 7-membered, fused or unfused and substituted or unsubstituted ring comprising the two oxygen atoms and also the boron atom; R 1 is hydrogen or alkyl, where the R 1 radicals may be the same or different when they occur more than once; R 2 ,R 3 are each independently hydrogen; substituted or unsubstituted alkyl, aryl or hetaryl; m is 1 or 2; n is from 3 to 6 where m=1; is from 2 to 8 where m=2, and mixtures thereof.
• US7795431B2
  申请人：——

  公开号：US7795431B2

  公开（公告）日：2010-09-14