1(4),8(11),15(18),22(25)-tetrakis(2,4-dimethyl-3-pentyloxy)phthalocyanine | 439812-66-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: 1(4),8(11),15(18),22(25)-tetrakis(2,4-dimethyl-3-pentyloxy)phthalocyanine
• 英文别名: 1,8,15,22-tetrakis(2,4-dimethyl-3-pentyloxy)phthalocyanine；1,8,15,22-tetrakis(2,4-dimethylpent-3-oxy)phthalocyanine；5,14,23,32-Tetrakis(2,4-dimethylpentan-3-yloxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene；5,14,23,32-tetrakis(2,4-dimethylpentan-3-yloxy)-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13(18),14,16,19(39),20,22(27),23,25,28,30(37),31(36),32,34-nonadecaene
• CAS: 439812-66-5
• 化学式: C₆₀H₇₄N₈O₄
• 分子量: 971.299
• InChiKey: MYOJTLLKPYUVHA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  17.1
• 重原子数：
  72
• 可旋转键数：
  16
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  146
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  十二羰基三钌 、 1(4),8(11),15(18),22(25)-tetrakis(2,4-dimethyl-3-pentyloxy)phthalocyanine 以 苯甲腈 为溶剂， 以53%的产率得到[Ru(CO)(1,8,15,22-tetrakis(1-isopropyl-2-methylpropoxy)phthalocyaninate)]
  参考文献：
  名称：

  通过轴向配位构建亚酞菁-卟啉和亚酞菁-酞菁杂二体。

  摘要：

  在吡啶存在下，在甲苯中用3-或4-羟基吡啶处理亚酞菁氯化硼（SPcCl）（SPcCl），得到相应的亚吡啶酞菁硼（III）SPc（3-OPy）（1）或SPc（4-OPy） ）（2）。这些化合物具有吡啶基，可以与一系列的锌（II）和钌（II）卟啉和酞菁轴向络合，形成相应的亚酞菁-卟啉和亚酞菁-酞菁杂双。如紫外可见光谱所揭示的，这些二元组中两个生色团之间的基态相互作用微不足道。还通过（1）1 H NMR和荧光光谱法研究了络合过程，证实了1：1的化学计量比。通过荧光滴定确定的缔合常数，通常，四吡咯钌（II）[（2.5-4.7）x 10（4）M（-1）]比锌（II）对应物[（0.3-1.8）x 10（4）M（-1 ）]。还通过X射线衍射分析确定了两个吡啶基亚酞菁1和2以及三个新型亚酞菁-卟啉杂合体的分子结构。

  DOI：

  10.1021/ic800756h

文献信息

• Coloured Particles for Electrophoretic Displays
  申请人：Fontana Margherita

  公开号：US20090296195A1

  公开（公告）日：2009-12-03

  The present invention discloses the use of functionalized particles as electrophoretic displaying particles, wherein the functionalized particles are SiO 2 , Al 2 O 3 or mixed SiO 2 and Al 2 O 3 particles comprising, covalently bound to an oxygen atom on the surface, a radical of formula (1), wherein R 1 and R 2 are independently of each other hydrogen, particle surface-O—, or a substituent, n is 1, 2, 3, 4, 5, 6, 7 or 8, B is the direct bond or a bridge member, and D is the residue of an organic chromophore.

  本发明揭示了功能化颗粒作为电泳显示颗粒的用途，其中功能化颗粒为SiO2、Al2O3或混合SiO2和Al2O3颗粒，其中这些颗粒通过共价键结合到表面上的氧原子，具有以下结构的自由基（1），其中R1和R2分别独立地为氢、颗粒表面-O-，或取代基，n为1、2、3、4、5、6、7或8，B为直接键或桥接成员，D为有机色团的残基。
• Synthesis, Structure, Spectroscopic Properties, and Electrochemistry of (1,8,15,22-Tetrasubstituted phthalocyaninato)lead Complexes
  作者：Yongzhong Bian、Lei Li、Jianmin Dou、Diana Y. Y. Cheng、Renjie Li、Changqin Ma、Dennis K. P. Ng、Nagao Kobayashi、Jianzhuang Jiang

  DOI：10.1021/ic049080o

  日期：2004.11.1

  Three (1,8,15,22-tetrasubstituted phthalocyaninato)lead complexes Pb[Pc(alpha-OR)(4)] [H(2)Pc(alpha-OC(5)H(11))(4) = 1,8,15,22-tetrakis(3-pentyloxy)phthalocyanine; H(2)Pc(alpha-OC(7)H(15))(4) = 1,8,15,22-tetrakis(2,4-dimethyl-3-pentyloxy)phthalocyanine; H(2)Pc(alpha-OC(10)H(7))(4) = 1,8,15,22-tetrakis(2-naphthyloxy)phthalocyanine] (1-3) have been prepared as racemic mixtures by treating the corresponding

  三个（1,8,15,22-四取代邻苯二甲腈基）铅配合物Pb [Pc（alpha-OR）（4）] [H（2）Pc（alpha-OC（5）H（11））（4）= 1 ，8,15,22-四（3-戊氧基）酞菁; H（2）Pc（α-OC（7）H（15））（4）= 1,8,15,22-四（2,4-二甲基-3-戊氧基）酞菁; H（2）Pc（α-OC（10）H（7））（4）= 1,8,15,22-四（2-萘氧基）酞菁]（1-3）已通过处理为外消旋混合物相应的无金属酞菁H（2）Pc（alpha-OR）（4）（4-6）与Pb（OAc）（2）.3H（2）O在正戊醇中回流。固态的Pb [Pc（α-OC（5）H（11））（4）]（1）的分子结构已通过单晶X射线衍射分析确定。该化合物具有非平面结构，在具有P2（1）/ c空间基团的单斜系统中结晶。每个晶胞包含两对对映体分子，它们通过一个分子的Pb原子与氮杂氮原子及其附近
• Synthesis, Spectroscopic Properties, and Structure of [Tetrakis(2,4‐dimethyl‐3‐pentyloxy)phthalocyaninato]metal Complexes
  作者：Wei Liu、Chi‐Hang Lee、Hoi‐Shan Chan、Thomas C. W. Mak、Dennis K. P. Ng

  DOI：10.1002/ejic.200300470

  日期：2004.1

  formed by treating 2 with CeCl3 and DBU in n-pentanol. The structures of the C4h isomers of the (phthalocyaninato)zinc and -cobalt complexes and the C4 isomer of the manganese analogue were also established by X-ray diffraction analyses. The palladium counterpart formed a novel 1:1 inclusion complex with oxalic acid, the crystal structure of which was also determined. (© Wiley-VCH Verlag GmbH & Co

  通过3-(2,4-二甲基-3-戊氧基)酞菁]金属络合物[MPc(OC7H15)4](M = Zn, Pd, Co)的循环四聚反应制备了一系列高溶解性[四(2,4-二甲基-3-戊氧基)酞菁]金属配合物-二甲基-3-戊氧基)邻苯二甲腈 (2) 在相应的金属盐和 1,8-二氮杂双环 [5.4.0] 十一碳-7-烯 (DBU) 的正戊醇中存在。对于 M = Zn 和 Pd，具有 C4h 和 C2v 对称性的两种主要异构体通过柱色谱分离并用各种光谱方法表征，而钴类似物仅显示 C4h 异构体。（酞菁）锰配合物 [MnClPc(OC7H15)4] 也通过金属化无金属酞菁 H2Pc(OC7H15)4 合成，该无金属酞菁 H2Pc(OC7H15)4 通过在正戊醇中用 CeCl3 和 DBU 处理 2 形成。(酞菁)锌和钴配合物的C4h异构体和锰类似物的C4异构体的结构也通过X射线衍射分析确定。钯对应物与草酸形成了一种新型的
• Cyanopyridine-Based Azo Dyes
  申请人：Hall-Goulle Véronique

  公开号：US20080010756A1

  公开（公告）日：2008-01-17

  A composition containing (A) an alkali-soluble binder and (B) an azo dye of formula (1), wherein D is the radical of a diazo component of the benzene, naphthalene, diphenyl, azobenzene, thiophene, benzothiazole, benzisothiazole, thiadiazole, indazole, benzotriazole, pyrazole, anthraquinone, naphtholic acid imide, chromone, phthalimide or diphenylene oxide series, X and Y are each independently of the other C 2 -C 6 alkylene, n is a number from 1 to 10, Z denotes oxygen or sulphur, and R 1 is —X[—O—Y] n -ZH, wherein X, Y, Z and n are as defined above, C 1 -C 12 alkyl which may be unsubstituted or substituted by one or more halogen atoms, hydroxy groups, amino groups or C 1 -C 8 alkoxy groups, C 5 -C 24 aryl which may be unsubstituted or substituted by one or more halogen atoms, hydroxy groups, amino groups, C 1 -C 12 alkyl groups or C 1 -C 8 alkoxy groups, C 6 -C 30 aralkyl which may be unsubstituted or substituted by one or more halogen atoms, hydroxy groups, amino groups, C 1 -C 12 alkyl groups or C 1 -C 8 alkoxy groups, or a C 5 -C 24 cycloaliphatic group which may be unsubstituted or substituted by one or more halogen atoms, hydroxy groups, amino groups, C 1 -C 12 alkyl groups or C 1 -C 8 alkoxy groups, is useful for the production of colour filters for liquid crystal displays, flat-panel displays, colour image pickup tubes, colour-copying machines etc.
• Compositions Containing Phthalocyanine Dyes
  申请人：Hall-Goulle Veronique

  公开号：US20080095950A1

  公开（公告）日：2008-04-24

  A composition containing (A) an alkali-soluble binder and (B) a phthalocyanine dye of formula (1), wherein Ri, R 2 , R 3 and R 4 are each independently of the other Ci-Ci 2 alkyl which may be unsubstituted or substituted by one or more hydroxy or mercapto groups, —X—[—O—Y] n -ZH, wherein X and Y are each independently of the other C 2 -C 6 alkylene, Z denotes oxygen or sulphur and n is a number from 1 to 10, C 5 -C 24 aryl which may be unsubstituted or substituted by one or more hydroxy or mercapto groups, or C 6 -C 30 aralkyl which may be unsubstituted or substituted by one or more hydroxy or mercapto groups, is useful for the production of colour filters for liquid crystal displays, flat-panel displays, colour image pickup tubes, colour-copying machines etc.