1-(4-nitrobenzyl)naphthalene | 3137-11-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-(4-nitrobenzyl)naphthalene
• 英文别名: 1-[(4-Nitrophenyl)methyl]naphthalene
• CAS: 3137-11-9
• 化学式: C₁₇H₁₃NO₂
• 分子量: 263.296
• InChiKey: HJBHEOSJKBYEOE-UHFFFAOYSA-N

物化性质

• 沸点：
  447.1±14.0 °C(Predicted)
• 密度：
  1.225±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.3
• 重原子数：
  20
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  45.8
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(4-nitrobenzyl)naphthalene 生成 1-Benzyl-naphthalene
  参考文献：
  名称：

  757.芳核的烷基化。第十四部分。萘

  摘要：

  DOI：

  10.1039/jr9650004101
• 作为产物：
  描述：

  1-溴代萘 、 4-硝基甲苯 在 palladium diacetate 、 caesium carbonate 、 三苯基膦 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以58%的产率得到1-(4-nitrobenzyl)naphthalene
  参考文献：
  名称：

  Palladium-catalyzed coupling reaction of 4-alkylnitrobenzenes with aryl bromides at their benzylic position

  摘要：

  4-Alkylnitrobenzenes effectively undergo coupling with aryl bromides at their benzylic position in the presence of a palladium catalyst and a base to give the corresponding mono- and/or di-arylated products in good yields. (C) 1998 Elsevier Science Ltd, All rights reserved.

  DOI：

  10.1016/s0040-4039(98)00832-6

文献信息

• Insights into the Role of New Palladium Pincer Complexes as Robust and Recyclable Precatalysts for Suzuki-Miyaura Couplings in Neat Water
  作者：Blanca Inés、Raul SanMartin、María Jesús Moure、Esther Domínguez

  DOI：10.1002/adsc.200900345

  日期：2009.9

  Suzuki–Miyaura biaryl and diarylmethane syntheses via the coupling of arylboronic acids with aryl and arylmethyl bromides are performed in water by means of two new CNC-type palladium pincer complexes. Good to excellent results (including high TON values and extended recycling procedures) are obtained in most cases for a range of electronically dissimilar halides and boronic acids. On the basis of

  水中的铃木-宫浦联芳基和二芳基甲烷通过芳基硼酸与芳基和芳基甲基溴的偶联而合成，是通过两种新型的CNC型钯钳配合物在水中进行的。在大多数情况下，对于一系列电子不同的卤化物和硼酸，可获得良好至优异的结果（包括较高的TON值和扩展的回收程序）。在一系列动力学研究，透射电子显微镜（TEM），汞滴试验和定量中毒实验的基础上，讨论了后者的钯环的实际作用，该环与钯纳米颗粒的形成和活性参与密切相关。
• Method for Producing Aromatic Compound Polymer
  申请人：Higashimura Hideyuki

  公开号：US20090018309A1

  公开（公告）日：2009-01-15

  A method for producing an aromatic compound polymer comprising oxidatively polymerizing one or more of aromatic compound(s) having two or more hydrogen atoms directly connected to aromatic ring(s), in the presence of an oxidizing agent, wherein the method employs a catalyst composed of a transition metal complex or a catalyst prepared from a transition metal complex and an activating agent, and said catalyst has a parameter P defined by the following formula (A) of 0.50 or more, and a parameter Eo defined by the following formula (B) of 0.50 [V] or more: P=Af/Ai (A) and Eo =( Epa+Epc )/2[V]  (B).

  一种生产芳香族化合物聚合物的方法，包括在氧化剂存在下氧化聚合具有两个或更多氢原子直接连接到芳香环的一个或多个芳香族化合物，其中该方法采用由过渡金属配合物或由过渡金属配合物和活化剂制备的催化剂，所述催化剂具有以下公式（A）定义的参数P，P的值为0.50或更高，并且具有以下公式（B）定义的参数Eo，Eo的值为0.50 [V]或更高：P=Af/Ai（A）和Eo=(Epa+Epc)/2[V]（B）。
• METHOD FOR PRODUCING AROMATIC COMPOUND POLYMER
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP1767560A1

  公开（公告）日：2007-03-28

  A method for producing an aromatic compound polymer comprising oxidatively polymerizing one or more of aromatic compound(s) having two or more hydrogen atoms directly connected to aromatic ring(s), in the presence of an oxidizing agent, wherein the method employs a catalyst composed of a transition metal complex or a catalyst prepared from a transition metal complex and an activating agent, and said catalyst has a parameter P defined by the following formula (A) of 0.50 or more, and a parameter Eo defined by the following formula (B) of 0.50 [V] or more: P=Af/Ai (wherein Ai represents an absorbance at an absorption maximum belonging in an absorption band located at the longest wavelength side in an absorption spectrum obtained for a solution containing the catalyst, in a ultraviolet to near-infrared wavelength region from 200 nm to 800 nm, and Af represents an absorbance at the same wavelength applied to the Ai, in an absorption spectrum in the above wavelength region obtained for a solution prepared by adding 3 equivalent of water per mole of the metal contained in the catalyst to the solution), and Eo=Epa+Epc/2V (wherein, Epa represents a peak potential at the oxidation side of an oxidation-reduction potential derived from the transition metal contained in the catalyst, at a potential of 0.50 [V] or more based on oxidation-reduction potential of ferrocene/ferrocenium ion measured with a cyclic voltammetry for the solution containing the catalyst, and Epc represents a peak potential at the reduction side corresponding to Epa by the same measurement).

  一种生产芳香族化合物聚合物的方法，包括在氧化剂存在下，氧化聚合一种或多种具有两个或两个以上氢原子直接连接到芳香环上的芳香族化合物，其中该方法采用由过渡金属络合物组成的催化剂或由过渡金属络合物和活化剂制备的催化剂，所述催化剂的参数P由下式(A)定义为0.50或以上，参数Eo由下式(B)定义为0.50[V]或以上：P=Af/Ai (其中，Ai 表示在含有催化剂的溶液的吸收光谱中，在 200 纳米至 800 纳米的紫外至近红外波长区域内，属于最长波长侧的吸收带的吸收最大值处的吸光度；Af 表示在通过向溶液中加入每摩尔催化剂所含金属 3 当量的水而制备的溶液的吸收光谱中，在上述波长区域内，与 Ai 相同波长处的吸光度），以及 Eo=Epa+Epc/2V (其中，Epa 代表由催化剂所含过渡金属衍生的氧化还原电位的氧化侧峰值电位，电位值为 0.50 [V] 或更高，该电位值基于对含有催化剂的溶液用循环伏安法测得的二茂铁/二茂铁离子的氧化还原电位；Epc 代表与 Epa 相对应的还原侧峰值电位，该测量值与 Epa 相同）。
• Method for producing aromatic compound polymer
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP2241547A1

  公开（公告）日：2010-10-20

  A method for producing an aromatic compound polymer by oxidatively polymerizing an aromatic compound in the presence of an oxidizing agent, wherein the method employs (a) a catalyst composed of a transition metal complex or (b) a catalyst prepared from a transition metal complex and an activating agent, and said transition metal complex is a vanadium di-nuclear complex represented by the following general formula (1-3): wherein A1, A2, A3 and A4 each independently represent an oxygen atom, or NR11, and B1, B2, B3 and B4 each independently represent -O- or NR12-; R1, R2, R3, R4, R5, R6, R7 and R8 each independently represent a C1-30 hydrocarbon group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; or a C1-40 hydrocarbonoxy group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; R9 and R10 each independently represent a C1-20 alkylene group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; or R9 and R10 represent a C6-60 arylene group optionally substituted by a C1-50 alkyl, C7-50 aralkyl, C1-50 alkoxy, nitro, cyano or halogen group; or R9 and R10 represent -O-, -S--SO2- or NR13-; and when R9 and R10 exist in a plural number respectively, they may be the same or different; m and n each independently represent an integer of 1 to 7; R11, R12 and R13 each independently represent a hydrogen atom or a C1-30 hydrocarbon group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; when R11, R12 and R13 exist in a plural number respectively, they may be the same or different; when both of A1 and A2 and/or both of A3 and A4 are together NR11 respectively, two R11s may combine to form a C1-20 divalent hydrocarbon group optionally substituted by a C1-30 hydrocarbon, C1-40 hydrocarbonxy, nitro, cyano or halogen group which connects A1 and A2 and/or A3 and A4 to each other; and when both of B1 and B2 and/or both of B3 and B4 are together -NR12- respectively, two R12s may combine to form a C1-20 divalent hydrocarbon group optionally substituted by a C1-30 hydrocarbon, C1-40 hydrocarbonxy, nitro, cyano or halogen group which connects B1 and B2 and/or B3 and B4 to each other.

  一种在氧化剂存在下通过氧化聚合芳香族化合物生产芳香族化合物聚合物的方法，其中该方法采用(a)由过渡金属络合物组成的催化剂或(b)由过渡金属络合物和活化剂制备的催化剂，所述过渡金属络合物是由以下通式(1-3)表示的钒二核络合物： 其中 A1、A2、A3 和 A4 各自独立地代表氧原子或 NR11，B1、B2、B3 和 B4 各自独立地代表 -O- 或 NR12-； R1、R2、R3、R4、R5、R6、R7 和 R8 各自独立地代表被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C1-30 烃基；或被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C1-40 烃氧基；R9 和 R10 各自独立地代表被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C1-20 亚烷基；或 R9 和 R10 代表任选被 C1-50 烷基、C7-50 芳基、C1-50 烷氧基、硝基、氰基或卤素基团取代的 C6-60 芳烯基团；或 R9 和 R10 代表 -O-、-S--SO2- 或 NR13-；当 R9 和 R10 分别以复数存在时，它们可以相同或不同；m 和 n 各自独立地代表 1 到 7 的整数；R11、R12 和 R13 各自独立地代表氢原子或任选被 C1-50 烷氧基、硝基、氰基或卤素取代的 C1-30 烃基；当 R11、R12 和 R13 分别以复数形式存在时，它们可以相同或不同；当 A1 和 A2 和/或 A3 和 A4 分别都是 NR11 时，两个 R11 可结合形成一个 C1-20 二价烃基，该烃基可选择被 C1-30 烃、C1-40 烃氧基、硝基、氰基或卤素基取代，该烃基将 A1 和 A2 和/或 A3 和 A4 连接在一起；当 B1 和 B2 和/或 B3 和 B4 分别为-NR12-时，两个 R12 可结合形成一个 C1-20 二价烃基，该烃基可选择被 C1-30 烃、C1-40 烃氧基、硝基、氰基或卤素基取代，该烃基将 B1 和 B2 和/或 B3 和 B4 连接在一起。
• Vanadium di-nuclear complex
  申请人：Sumitomo Chemical Company, Limited

  公开号：EP2241548A1

  公开（公告）日：2010-10-20

  A vanadium di-nuclear complex represented by the following general formula (1-3): wherein A1, A2, A3 and A4 each independently represent an oxygen atom, or NR11, and B1, B2, B3 and B4 each independently represent -O- or NR12-; R1, R2, R3, R4, R5, R6, R7 and R8 each independently represent a C1-30 hydrocarbon group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; or a C1-40 hydrocarbonoxy group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; R9 and R10 each independently represent a C 1-20 alkylene group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; or R9 and R10 represent a C6-60 arylene group optionally substituted by a C1-50 alkyl, C7-50 aralkyl, C1-50 alkoxy, nitro, cyano or halogen group; or R9 and R10 represent -O-, -S--SO2- or NR13-; and when R9 and R10 exist in a plural number respectively, they may be the same or different; m and n each independently represent an integer of 1 to 7; R11, R12 and R13 each independently represent a hydrogen atom or a C1-30 hydrocarbon group optionally substituted by a C1-50 alkoxy, nitro, cyano or halogen group; when R11, R12 and R13 exist in a plural number respectively, they may be the same or different; when both of A1 and A2 and/or both of A3 and A4 are together NR11 respectively, two R11s may combine to form a C1-20 divalent hydrocarbon group optionally substituted by a C1-30 hydrocarbon, C1-40 hydrocarbonxy, nitro, cyano or halogen group which connects A1 and A2 and/or A3 and A4 to each other; and when both of B1 and B2 and/or both of B3 and B4 are together -NR12- respectively, two R12s may combine to form a C1-20 divalent hydrocarbon group optionally substituted by a C1-30 hydrocarbon, C1-40 hydrocarbonxy, nitro, cyano or halogen group which connects B1 and B2 and/or B3 and B4 to each other.

  由以下通式（1-3）表示的二核钒络合物： 其中 A1、A2、A3 和 A4 各自独立地代表氧原子或 NR11，B1、B2、B3 和 B4 各自独立地代表 -O- 或 NR12-； R1、R2、R3、R4、R5、R6、R7 和 R8 各自独立地代表被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C1-30 烃基；或被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C1-40 烃氧基；R9 和 R10 各自独立地代表被 C1-50 烷氧基、硝基、氰基或卤素基团任选取代的 C 1-20 亚烷基；或 R9 和 R10 代表任选被 C1-50 烷基、C7-50 芳基、C1-50 烷氧基、硝基、氰基或卤素基团取代的 C6-60 芳烯基团；或 R9 和 R10 代表 -O-、-S--SO2- 或 NR13-；当 R9 和 R10 分别以复数存在时，它们可以相同或不同；m 和 n 各自独立地代表 1 到 7 的整数；R11、R12 和 R13 各自独立地代表氢原子或任选被 C1-50 烷氧基、硝基、氰基或卤素取代的 C1-30 烃基；当 R11、R12 和 R13 分别以复数形式存在时，它们可以相同或不同；当 A1 和 A2 和/或 A3 和 A4 分别都是 NR11 时，两个 R11 可结合成一个 C1-20 二价烃基，该烃基可选择被 C1-30 烃、C1-40 烃氧基、硝基、氰基或卤素基取代，该烃基将 A1 和 A2 和/或 A3 和 A4 连接在一起；当 B1 和 B2 和/或 B3 和 B4 分别都是-NR12-时，两个 R12 可结合成一个 C1-20 二价烃基，该烃基可选择被 C1-30 烃、C1-40 烃氧基、硝基、氰基或卤素基取代，该烃基将 B1 和 B2 和/或 B3 和 B4 连接在一起。