2-cyanomethylmercapto-4-phenylthiazole | 103483-15-4

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-cyanomethylmercapto-4-phenylthiazole
• 英文别名: cyanomethyl 2-(4-phenylthiazolyl) sulfide；(4-Phenylthiazole-2-ylthio)acetonitrile；2-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]acetonitrile
• CAS: 103483-15-4
• 化学式: C₁₁H₈N₂S₂
• 分子量: 232.33
• InChiKey: URSIHXVFHUUAQS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  90.2
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-cyanomethylmercapto-4-phenylthiazole 、 水杨醛 在 盐酸 、 sodium hydroxide 作用下， 生成 3-(4'-phenylthiazol-2'-ylthio)coumarin
  参考文献：
  名称：

  Ahluwalia; Mallika; Singh, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 7, p. 667 - 670

  摘要：

  DOI：
• 作为产物：
  描述：

  2-巯基-4-苯基噻唑 、 氯乙腈 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 反应 2.0h， 以73%的产率得到2-cyanomethylmercapto-4-phenylthiazole
  参考文献：
  名称：

  Ahluwalia; Mallika; Singh, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 7, p. 667 - 670

  摘要：

  DOI：

文献信息

• Electrolytic Partial Fluorination of Organic Compounds. 64.¹ Anodic Mono- and Difluorination of Thiazolyl Sulfides
  作者：Sayed M. Riyadh、Toshio Fuchigami

  DOI：10.1021/jo020411t

  日期：2002.12.1

  The anodic fluorination of 2-thiazolyl methyl sulfide, 2-thiazolyl propargyl sulfide, and 2-thiazolyl acetonyl sulfide was successfully carried out to provide the corresponding 5-fluorothiazole and 2,5,5-trifluorothiazoline derivatives. The latter products were readily hydrolyzed to give isolable 5,5-difluoro-2-hydroxythiazoline derivatives. On the other hand, anodic fluorination of 2-thiazolyl cyanomethyl sulfide afforded 5-fluorothiazole and a-fluorinated thiazole derivatives. Thus, the product selectivity was found to be greatly changed by the electron-withdrawing ability of substituents at the side chain of the thiazole ring. This is the first report of a successful anodic fluorination of a thiazole ring.
• AHLUWALIA, V. K.;MALLIKA, N.;SINGH, R. P.;KHANDURI, C. H., INDIAN J. CHEM. B, 29,(1990) N, C. 667-670
  作者：AHLUWALIA, V. K.、MALLIKA, N.、SINGH, R. P.、KHANDURI, C. H.

  DOI：——

  日期：——
• Ahluwalia; Mallika; Singh, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 7, p. 667 - 670
  作者：Ahluwalia、Mallika、Singh、Khanduri

  DOI：——

  日期：——