[26-(2-Butyloctanoyloxy)-7-undecacyclo[30.6.2.210,13.02,27.03,24.05,22.08,21.011,20.012,17.029,39.036,40]dotetraconta-1(39),2(27),3(24),4,8(21),9,11(20),12,14,16,18,22,28,30,32(40),33,35,37,41-nonadecaenyl] 2-butyloctanoate | 1352790-80-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: [26-(2-Butyloctanoyloxy)-7-undecacyclo[30.6.2.210,13.02,27.03,24.05,22.08,21.011,20.012,17.029,39.036,40]dotetraconta-1(39),2(27),3(24),4,8(21),9,11(20),12,14,16,18,22,28,30,32(40),33,35,37,41-nonadecaenyl] 2-butyloctanoate
• 英文别名: [26-(2-butyloctanoyloxy)-7-undecacyclo[30.6.2.210,13.02,27.03,24.05,22.08,21.011,20.012,17.029,39.036,40]dotetraconta-1(39),2(27),3(24),4,8(21),9,11(20),12,14,16,18,22,28,30,32(40),33,35,37,41-nonadecaenyl] 2-butyloctanoate
• CAS: 1352790-80-7
• 化学式: C₆₆H₇₀O₄
• 分子量: 927.279
• InChiKey: LRAQYOIUOMZXIV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  20.9
• 重原子数：
  70
• 可旋转键数：
  22
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-butyloctanoyl chloride 、 在 吡啶 、 4-二甲氨基吡啶 作用下， 以 四氢呋喃 为溶剂， 反应 4.08h， 以7%的产率得到[26-(2-Butyloctanoyloxy)-7-undecacyclo[30.6.2.210,13.02,27.03,24.05,22.08,21.011,20.012,17.029,39.036,40]dotetraconta-1(39),2(27),3(24),4,8(21),9,11(20),12,14,16,18,22,28,30,32(40),33,35,37,41-nonadecaenyl] 2-butyloctanoate
  参考文献：
  名称：

  [EN] LEAVING SUBSTITUENT-CONTAINING COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FORMED THEREFROM, ORGANIC ELECTRONIC DEVICE, ORGANIC THIN-FILM TRANSISTOR AND DISPLAY DEVICE USING THE ORGANIC SEMICONDUCTOR MATERIAL, METHOD FOR PRODUCING FILM-LIKE PRODUCT, PI-
  [FR] COMPOSÉ CONTENANT UN SUBSTITUANT PARTANT, MATÉRIAU SEMI-CONDUCTEUR ORGANIQUE FORMÉ À PARTIR DE CE COMPOSÉ, DISPOSITIF ÉLECTRONIQUE ORGANIQUE, TRANSISTOR ORGANIQUE EN COUCHE MINCE ET DISPOSITIF D'AFFICHAGE UTILISANT LE MATÉRIAU SEMI-CONDUCTEUR ORGANIQ

  摘要：

  一种含有离去基团的化合物，其由通用式（I）表示，其中该含有离去基团的化合物可以通过向该含有离去基团的化合物施加能量，转化为通用式（Ia）表示的化合物和通用式（II）表示的化合物，在通用式（I）、（Ia）和（II）中，X和Y分别表示氢原子或离去基团，其中X和Y中的一个是离去基团，另一个是氢原子；Q2至Q5分别表示氢原子、卤素原子或一价有机基团；Q1和Q6分别表示氢原子或除去基团以外的一价有机基团；在Q1至Q6表示的一价有机基团中，相邻的一价有机基团可以连接在一起形成环。

  公开号：

  WO2011158953A1

文献信息

• LEAVING SUBSTITUENT-CONTAINING COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FORMED THEREFROM, ORGANIC ELECTRONIC DEVICE, ORGANIC THIN-FILM TRANSISTOR AND DISPLAY DEVICE USING THE ORGANIC SEMICONDUCTOR MATERIAL, METHOD FOR PRODUCING FILM-LIKE PRODUCT, PI-ELECTRON CONJUGATED COMPOUND AND METHOD FOR PRODUCING THE PI ELECTRON CONJUGATED COMPOUND
  申请人：Goto Daisuke

  公开号：US20130095605A1

  公开（公告）日：2013-04-18

  A leaving substituent-containing compound represented by General Formula (I), wherein the leaving substituent-containing compound can be converted to a compound represented by General Formula (Ia) and a compound represented by General Formula (II), by applying energy to the leaving substituent-containing compound, in General Formulas (I), (Ia) and (II), X and Y each represent a hydrogen atom or a leaving substituent, where one of X and Y is the leaving substituent and the other is the hydrogen atom; Q 2 to Q 5 each represent a hydrogen atom, a halogen atom or a monovalent organic group; Q 1 and Q 6 each represent a hydrogen atom or a monovalent organic group other than the leaving substituent; and among the monovalent organic groups represented by Q 1 to Q 6 , adjacent monovalent organic groups may be linked together to form a ring.
• [EN] LEAVING SUBSTITUENT-CONTAINING COMPOUND, ORGANIC SEMICONDUCTOR MATERIAL FORMED THEREFROM, ORGANIC ELECTRONIC DEVICE, ORGANIC THIN-FILM TRANSISTOR AND DISPLAY DEVICE USING THE ORGANIC SEMICONDUCTOR MATERIAL, METHOD FOR PRODUCING FILM-LIKE PRODUCT, PI-<br/>[FR] COMPOSÉ CONTENANT UN SUBSTITUANT PARTANT, MATÉRIAU SEMI-CONDUCTEUR ORGANIQUE FORMÉ À PARTIR DE CE COMPOSÉ, DISPOSITIF ÉLECTRONIQUE ORGANIQUE, TRANSISTOR ORGANIQUE EN COUCHE MINCE ET DISPOSITIF D'AFFICHAGE UTILISANT LE MATÉRIAU SEMI-CONDUCTEUR ORGANIQ
  申请人：RICOH CO LTD

  公开号：WO2011158953A1

  公开（公告）日：2011-12-22

  A leaving substituent-containing compound represented by General Formula (I), wherein the leaving substituent-containing compound can be converted to a compound represented by General Formula (Ia) and a compound represented by General Formula (II), by applying energy to the leaving substituent-containing compound, in General Formulas (I), (Ia) and (II), X and Y each represent a hydrogen atom or a leaving substituent, where one of X and Y is the leaving substituent and the other is the hydrogen atom; Q2 to Q5 each represent a hydrogen atom, a halogen atom or a monovalent organic group; Q1 and Q6 each represent a hydrogen atom or a monovalent organic group other than the leaving substituent; and among the monovalent organic groups represented by Q1 to Q6, adjacent monovalent organic groups may be linked together to form a ring.

  一种含有离去基团的化合物，其由通用式（I）表示，其中该含有离去基团的化合物可以通过向该含有离去基团的化合物施加能量，转化为通用式（Ia）表示的化合物和通用式（II）表示的化合物，在通用式（I）、（Ia）和（II）中，X和Y分别表示氢原子或离去基团，其中X和Y中的一个是离去基团，另一个是氢原子；Q2至Q5分别表示氢原子、卤素原子或一价有机基团；Q1和Q6分别表示氢原子或除去基团以外的一价有机基团；在Q1至Q6表示的一价有机基团中，相邻的一价有机基团可以连接在一起形成环。