(E)-methyl 3-phenyl-3-phenylthiopropenoate | 34875-13-3

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: (E)-methyl 3-phenyl-3-phenylthiopropenoate
• 英文别名: cis-β-Phenylthio-zimtsaeuremethylester；methyl (E)-3-phenyl-3-phenylsulfanylprop-2-enoate
• CAS: 34875-13-3
• 化学式: C₁₆H₁₄O₂S
• 分子量: 270.352
• InChiKey: YGTAIVSANUZYGZ-NTCAYCPXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  苯丙炔酸甲酯 、 sodium thiophenolate 生成 (E)-methyl 3-phenyl-3-phenylthiopropenoate
  参考文献：
  名称：

  HAMED, EZZAT A.;MOUSSA, ADEL M.;YOUSSEF, ABDEL-HAMID A., J. PHYS. ORG. CHEM., 3,(1990) N, C. 375-378

  摘要：

  DOI：

文献信息

• Hamed, Ezzat A., Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 1997, vol. 36, # 1, p. 102 - 104
  作者：Hamed, Ezzat A.

  DOI：——

  日期：——
• Substitution and elimination reactions in chloro olefins. 3. Reactions of methyl .beta.-chlorocinnamates with thiophenoxide ion
  作者：Abdel-Hamid A. Youssef、Saber M. Sharaf、Samir K. El-Sadany、Ezzat A. Hamad

  DOI：10.1021/jo00332a010

  日期：1981.9
• The first synthesis of β-phenylchalcogeno-α,β-unsaturated esters via hydrochalcogenation of acetylenes using microwave and solvent-free conditions
  作者：Gelson Perin、Raquel G. Jacob、Francisco de Azambuja、Giancarlo V. Botteselle、Geonir M. Siqueira、Rogério A. Freitag、Eder J. Lenardão

  DOI：10.1016/j.tetlet.2005.01.060

  日期：2005.3

  A simple, clean, and efficient solvent-free protocol was developed for hydrochalcogenation of methyl propiolate derivatives with phenylchalcogenolate anion generated in situ from the respective diphenyl dichalcogenide (S, Se, Te) using alumina supported sodium borohydride. This efficient and improved method is general and furnishes the (Z)-beta-phenylchalcogeno-alpha,beta-unsaturated esters in yields and with selectivity comparable to those using organic solvent and inert atmosphere. The use of MW irradiation facilitates the procedure and accelerates the reaction. (C) 2005 Elsevier Ltd. All rights reserved.
• HAMED, EZZAT A.;MOUSSA, ADEL M.;YOUSSEF, ABDEL-HAMID A., J. PHYS. ORG. CHEM., 3,(1990) N, C. 375-378
  作者：HAMED, EZZAT A.、MOUSSA, ADEL M.、YOUSSEF, ABDEL-HAMID A.

  DOI：——

  日期：——
• BHONGLE, N. N.;GOGTE, V. N.;VANKAR, Y. D., INDIAN J. CHEM., 1982, 21, N 8, 724-728
  作者：BHONGLE, N. N.、GOGTE, V. N.、VANKAR, Y. D.

  DOI：——

  日期：——