sorbic acid 2-phenylethyl ester | 1003863-62-4

• 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: sorbic acid 2-phenylethyl ester
• 英文别名: (2E,4E)-sorbic acid 2-phenylethyl ester；Phenethyl hexa-2,4-dienoate；2-phenylethyl (2E,4E)-hexa-2,4-dienoate
• CAS: 1003863-62-4
• 化学式: C₁₄H₁₆O₂
• 分子量: 216.28
• InChiKey: PPZYQYDDSJRELL-XPQLPGEHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  16
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  苯乙醇 、 phenyl 2,4-hexadienoate 在 tetrabutylammonium tricarbonylnitrosylferrate 4 A molecular sieve 作用下， 以 正己烷 为溶剂， 反应 24.0h， 以68%的产率得到sorbic acid 2-phenylethyl ester
  参考文献：
  名称：

  A Nucleophilic Fe Catalyst for Transesterifications under Neutral Conditions

  摘要：

  Carboxylic esters belong to the most important functional groups in organic chemistry. Strong efforts have been made in developing mild catalytic procedures for their preparation. Among the various methods developed to date, transesterifications have occupied an important space. In the present paper, a new catalytic method for this process based on the use of nucleophilic Fe(-II) complexes is presented. Evidence for the formation of an intermediate acyl Fe complex will be presented as well as investigations on scope and limitations.

  DOI：

  10.1021/ol702580a

文献信息

• Attractive aerobic access to the α,β-unsaturated acyl azolium intermediate: oxidative NHC catalysis via multistep electron transfer
  作者：L. Ta、A. Axelsson、H. Sundén

  DOI：10.1039/c5gc01965f

  日期：——

  Employing a system of electron transfer mediators (ETMs) enables the use of oxygen as the terminal oxidant for oxidative NHC-catalyzed reactions.

  使用电子传递介体（ETM）系统可以将氧气用作NHC催化氧化反应的末端氧化剂。
• Cl₃CCONH₂/PPh₃: A Versatile Reagent for Synthesis of Esters
  作者：Oraphin Chantarasriwong、Doo Ok Jang、Warinthorn Chavasiri

  DOI：10.1080/00397910801979361

  日期：2008.8.19

  Cl3CCONH(2)/PPh(3) was a versatile reagent to convert carboxylic acids into their corresponding acid chlorides. This intermediate was clearly confirmed by spectroscopic methods (IR, (1)H, (13)C NMR). This one-pot reaction of in situ acid chloride generated with various alcohols successfully furnished the corresponding esters in moderate to excellent yields.
• A Nucleophilic Fe Catalyst for Transesterifications under Neutral Conditions
  作者：Silja Magens、Melanie Ertelt、Anja Jatsch、Bernd Plietker

  DOI：10.1021/ol702580a

  日期：2008.1.1

  Carboxylic esters belong to the most important functional groups in organic chemistry. Strong efforts have been made in developing mild catalytic procedures for their preparation. Among the various methods developed to date, transesterifications have occupied an important space. In the present paper, a new catalytic method for this process based on the use of nucleophilic Fe(-II) complexes is presented. Evidence for the formation of an intermediate acyl Fe complex will be presented as well as investigations on scope and limitations.