diethyl 1-phenyl-1H-pyrrole-3,4-dicarboxylate | 78945-64-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: diethyl 1-phenyl-1H-pyrrole-3,4-dicarboxylate
• 英文别名: Diethyl 1-phenyl-1h-pyrrole-3,4-dicarboxylate；diethyl 1-phenylpyrrole-3,4-dicarboxylate
• CAS: 78945-64-9
• 化学式: C₁₆H₁₇NO₄
• 分子量: 287.315
• InChiKey: CIPHWSAEUHAWLP-UHFFFAOYSA-N

物化性质

• 熔点：
  46-48 °C(Solv: ethyl acetate (141-78-6); ligroine (8032-32-4))
• 沸点：
  200 °C(Press: 0.5 Torr)
• 密度：
  1.15±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  57.5
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  diethyl 1-phenyl-1H-pyrrole-3,4-dicarboxylate 在 镍 氢氧化钾 、 氯化亚砜 作用下， 以 水 、 丙酮 为溶剂， 反应 37.0h， 生成 1-fenil-3,4-diformilpirrolo
  参考文献：
  名称：

  Garuti, L.; Ferranti, A.; Giovanninetti, G., Farmaco, Edizione Scientifica, 1981, vol. 36, # 6, p. 393 - 399

  摘要：

  DOI：
• 作为产物：
  描述：

  甲酸基丁二酸二乙酯 在 乙醚 、 乙醇 、 硫酸 、 sodium ethanolate 作用下， 生成 diethyl 1-phenyl-1H-pyrrole-3,4-dicarboxylate
  参考文献：
  名称：

  THE SYNTHESIS OF FURAN, THIOPHENE, AND PYRROLE-3,4-DICARBOXYLIC ESTERS

  摘要：

  DOI：

  10.1021/jo01375a017

文献信息

• Practical one-pot sequential procedure for the preparation of N-arylated 3,4-disubstituted pyrroles from alkenes
  作者：Rui Zhu、Lixin Xing、Yantao Liu、Fangkun Deng、Xinyan Wang、Yuefei Hu

  DOI：10.1016/j.jorganchem.2008.09.051

  日期：2008.12

  copper-catalyzed N-arylation of pyrrole proceeded sequentially in a single flask to give N-arylated 3,4-disubstituted pyrroles smoothly. Thus, a series of desired N-arylated pyrroles were prepared directly from the electron-deficient alkenes.

  通过使用吨丁醇钠和Cs 2 CO 3作为混合基，面包车Leusen吡咯合成和铜催化Ñ吡咯-arylation在单个烧瓶依次进行，得到Ñ -arylated 3,4-二取代的吡咯顺利。因此，直接从缺电子的烯烃制备了一系列所需的N-芳基吡咯。
• MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME
  申请人：TABATA Masayoshi

  公开号：US20110224343A1

  公开（公告）日：2011-09-15

  The present invention provides a modifier for aromatic polyesters which enhances the melt fluidity of aromatic polyesters without a significant decrease in the heat resistance of the aromatic polyesters, and an aromatic polyester resin composition including the modifier for aromatic polyesters. The present invention relates to a modifier for aromatic polyesters comprising polyhydric phenol residues and residues of aromatic polycarboxylic acid, acid halide or acid anhydride thereof, and the modifier comprises a material having a structure composed of a first residue selected from the group consisting of divalent residues represented by Formula (I): —Ar—W 1 x —Ar— and by Formula (II): —Ar—, the first residues being bonded to two identical or different second residues selected from the group consisting of monovalent residues represented by Formula (III): and monovalent residues represented by Formula (IV): —O—C(O)—R 7 —.

  本发明提供了一种用于芳香族聚酯的改性剂，可以增强芳香族聚酯的熔融流动性，而不明显降低芳香族聚酯的耐热性，以及包括该改性剂的芳香族聚酯树脂组合物。本发明涉及一种用于芳香族聚酯的改性剂，包括多羟基酚残基和芳香族多羧酸、酸卤或其酸酐残基，该改性剂包括具有以下结构的材料：第一残基，选择自由式(I)所代表的二价残基：—Ar—W1x—Ar—和自由式(II)所代表的：—Ar—，第一残基与选择自由式(III)所代表的单价残基：和自由式(IV)所代表的单价残基：—O—C(O)—R7—的两个相同或不同的第二残基结合。
• A Simple Synthesis of 1-Substituted Diethyl Pyrrole-3,4-dicarboxylates
  作者：Luka Škrlep、Andreja Čerček-Hočevar、Renata Jakše、Branko Stanovnik、Jurij Svete

  DOI：10.1515/znb-2009-0614

  日期：2009.6.1

  A series of 1-substituted diethyl 1H-pyrrole-3,4-dicarboxylates 4a - o were prepared in 14 - 93% yield by acid-catalysed treatment of diethyl 2,3-bis[(E,E)-(dimethylamino)-methylidene]succinate (2) with various aliphatic and (hetero)aromatic primary amines 3a - o. The configuration of the C=C double bonds in the bis-enaminone 2 was determined by 1H NMR and HMBC spectroscopy.

  一系列1-取代的二乙基1H-吡咯-3,4-二羧酸酯4a - o通过酸催化处理二乙酸2,3-双[(E,E)-(二甲氨基)-甲基亚甲基]琥珀酸二乙酯(2)与各种脂肪族和(杂)芳香族一级胺3a - o反应，产率为14%至93%。双亚甲基酮2中的C=C双键构型通过1H NMR和HMBC光谱确定。
• Atomistic Engineering of Chemiluminogens: Synthesis, Properties and Polymerization of 2,3-Dihydro-Pyrrolo[3,4-d]Pyridazine-1,4-Dione Scaffolds
  作者：Melek Pamuk Algi、Zahide Oztas、Seha Tirkeş、Atilla Cihaner、Fatih Algi

  DOI：10.1007/s10895-016-1978-x

  日期：2017.3

  chemiluminescent compounds containing 2,5-di(thien-2-yl)pyrrole and pyridazine units, namely 5,7-di(thiophen-2-yl)-2,3-dihydro-1H-pyrrolo[3,4-d]pyridazine-1,4(6H)-dione (5) and 6-phenyl-5,7-di(thiophen-2-yl)-2,3-dihydro-1H-pyrrolo[3,4-d]pyridazine-1,4(6H)-dione (6), were successfully synthesized and electrochemically polymerized. The compounds have chemiluminescent properties and glow in the presence of hydrogen

  两种含有2,5-二（噻吩-2-基）吡咯和哒嗪单元的化学发光化合物，即5,7-二（噻吩-2-基）-2,3-二氢-1H-吡咯并[3,4-d ]哒嗪-1,4（6H）-二酮（5）和6-苯基-5,7-二（噻吩-2-基）-2,3-二氢-1H-吡咯并[3,4-d]哒嗪- 1,4（6H）-二酮（6）已成功合成并进行了电化学聚合。该化合物具有化学发光特性，并在碱性介质中过氧化氢的存在下发光。通过使用Fe 3+离子，血红素（1.0 ppm）或血液样本（1.0 ppm）作为催化剂，可以大大提高辉光的强度。化合物5和6与Ag / AgCl相比，在1.08 V和1.33 V处有一个明确定义的不可逆氧化峰。通过在BF 3的存在下重复电势扫描，成功地进行了5和6的电化学聚合。溶于乙腈的0.1 M LiClO 4电解质溶液中的Et2O 。发现聚合物P5和P6的电子带隙（E g）分别为2.02eV和2.16eV。另一方面，
• AROMATIC POLYESTER
  申请人：Muroran Institute of Technology

  公开号：EP2479203A1

  公开（公告）日：2012-07-25

  The present invention provides an aromatic polyester which is substantially free from the occurrence of coloration and retains significantly high transparency even after being thermally processed at high temperature and which has high flowability. The aromatic polyester contains a polyhydric phenol residue and a residue of any one of aromatic polycarboxylic acid, halide thereof, and anhydride thereof, and terminals of the aromatic polyester have a structure represented by the formula -C(O)-R. The aromatic polyester has an end-capping rate of 90% or higher and a weight average molecular weight (Mw) ranging from 3,000 to 1,000,000.

  本发明提供了一种芳香族聚酯，该聚酯基本上不会发生着色，即使在高温热加工后仍能保持明显的高透明度，并且具有高流动性。芳香族聚酯含有多羟基苯酚残留物和芳香族多羧酸、其卤化物和其酸酐中任意一种的残留物，芳香族聚酯的端基具有式 -C(O)-R 所代表的结构。芳香族聚酯的端盖率为 90% 或更高，重量平均分子量（Mw）为 3,000 至 1,000,000 之间。