Sodium;4-amino-5-benzoyl-3-cyanothiophene-2-thiolate | 1167429-87-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Sodium;4-amino-5-benzoyl-3-cyanothiophene-2-thiolate
• CAS: 1167429-87-9
• 化学式: C₁₂H₇N₂OS₂*Na
• 分子量: 282.322
• InChiKey: AEXMDFSUCMUHBC-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -0.66
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  96.1
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  Sodium;4-amino-5-benzoyl-3-cyanothiophene-2-thiolate 、 2,3,4,6-四乙酰氧基-alpha-D-吡喃葡萄糖溴化物 以 乙醇 、 丙酮 为溶剂， 反应 14.0h， 生成 [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-(4-amino-5-benzoyl-3-cyanothiophen-2-yl)sulfanyloxan-2-yl]methyl acetate
  参考文献：
  名称：

  Design and Synthesis of the First Thiophene Thioglycosides

  摘要：

  A novel reported method for preparation of the first thiophene thioglycosides via a one-pot reaction of sodium thiophenethiolate salts with 2,3,4,6-tetra-O-acetyl--D-gluco- and galactopyranosyl bromides has been studied. The sodium thiophenethiolate salts were prepared using sodium cyanoethylene thiolate salts.

  DOI：

  10.1080/00397910802590928
• 作为产物：
  描述：

  Sodium;2,2-dicyano-1-phenacylsulfanylethenethiolate 在 sodium ethanolate 作用下， 以 乙醇 为溶剂， 反应 2.0h， 以80%的产率得到Sodium;4-amino-5-benzoyl-3-cyanothiophene-2-thiolate
  参考文献：
  名称：

  Design and Synthesis of the First Thiophene Thioglycosides

  摘要：

  A novel reported method for preparation of the first thiophene thioglycosides via a one-pot reaction of sodium thiophenethiolate salts with 2,3,4,6-tetra-O-acetyl--D-gluco- and galactopyranosyl bromides has been studied. The sodium thiophenethiolate salts were prepared using sodium cyanoethylene thiolate salts.

  DOI：

  10.1080/00397910802590928

文献信息

• BRIEL, DETLEF;WAGNER, GUNTHER;WILL, SYLVIA;LOHMANN, DIETER;LABAN, GUNTER
  作者：BRIEL, DETLEF、WAGNER, GUNTHER、WILL, SYLVIA、LOHMANN, DIETER、LABAN, GUNTER

  DOI：——

  日期：——
• Design and Synthesis of the First Thiophene Thioglycosides
  作者：Galal H. Elgemeie、Shahinaz H. Elsayed、Ashraf S. Hassan

  DOI：10.1080/00397910802590928

  日期：2009.4.22

  A novel reported method for preparation of the first thiophene thioglycosides via a one-pot reaction of sodium thiophenethiolate salts with 2,3,4,6-tetra-O-acetyl--D-gluco- and galactopyranosyl bromides has been studied. The sodium thiophenethiolate salts were prepared using sodium cyanoethylene thiolate salts.