triethyl (E)-1-cyanoocta-2,7-diene-2,5,5-tricarboxylate | 1152418-74-0

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: triethyl (E)-1-cyanoocta-2,7-diene-2,5,5-tricarboxylate
• CAS: 1152418-74-0
• 化学式: C₁₈H₂₅NO₆
• 分子量: 351.4
• InChiKey: SRVMMPGSGWWPJE-NTEUORMPSA-N

物化性质

• 沸点：
  446.8±45.0 °C(predicted)
• 密度：
  1.104±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.47
• 重原子数：
  25.0
• 可旋转键数：
  11.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  102.69
• 氢给体数：
  0.0
• 氢受体数：
  7.0

反应信息

• 作为产物：
  描述：

  氰基甲酸乙酯 、 2-Allyl-2-buta-2,3-dienyl-malonic acid diethyl ester 在 bis(1,5-cyclooctadiene)nickel (0) 、 二甲基苯基磷 作用下， 以 甲苯 为溶剂， 反应 9.0h， 生成 triethyl 3-cyanoocta-1,7-diene-2,5,5-tricarboxylate 、 triethyl (Z)-1-cyanoocta-2,7-diene-2,5,5-tricarboxylate 、 triethyl (E)-1-cyanoocta-2,7-diene-2,5,5-tricarboxylate
  参考文献：
  名称：

  Hirata, Yasuhiro; Inui, Tomohiko; Nakao, Yoshiaki, Journal of the American Chemical Society, 2009, vol. 131, p. 6624 - 6631

  摘要：

  DOI：

文献信息

• Palladium Nanoparticles on Graphite Oxide and Its Functionalized Graphene Derivatives as Highly Active Catalysts for the Suzuki−Miyaura Coupling Reaction
  作者：Gil M. Scheuermann、Luigi Rumi、Peter Steurer、Willi Bannwarth、Rolf Mülhaupt

  DOI：10.1021/ja901105a

  日期：2009.6.17

  Pd2+-exchanged graphite oxide and chemically derived graphenes therefrom were employed as supports for Pd nanoparticles. The influence of catalyst preparation, carbon functionalization, and catalyst morphology on the catalytic activity in the Suzuki-Miyaura coupling reactions was investigated. The catalysts were characterized by means of spectroscopy (FT-IR, solid-state C-13 NMR, AAS, XPS), X-ray scattering (WAXS), surface area analysis (BET, methylene blue adsorption), and electron microscopy (TEM, ESEM). In contrast to the conventional Pd/C catalyst, graphite oxide and graphene-based catalysts gave much higher activities with turnover frequencies exceeding 39 000 h(-1), accompanied by very low palladium leaching (<1 ppm).