(6-Chlor-hexyl)-acetyl-sulfid | 408340-28-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 硫代羧酸及其衍生物
• 英文名称: (6-Chlor-hexyl)-acetyl-sulfid
• 英文别名: S-(6-chlorohexyl) ethanethioate
• CAS: 408340-28-3
• 化学式: C₈H₁₅ClOS
• 分子量: 194.726
• InChiKey: XSZPRKCDGBABBZ-UHFFFAOYSA-N

物化性质

• 沸点：
  256.4±23.0 °C(Predicted)
• 密度：
  1.063±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  11
• 可旋转键数：
  7
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (6-Chlor-hexyl)-acetyl-sulfid 在 甲醇 、 三氟化硼乙醚 、 magnesium 作用下， 反应 96.0h， 生成
  参考文献：
  名称：

  Preparation of ω-tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides: Useful reagents for the synthesis of 1-(ω-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes (C60)

  摘要：

  omega-Tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides are prepared as Grignard reagents containing protected mercaptoalkyl chains, which are useful for the direct introduction of omega-mercaptoalkyl chains to electrophiles. In order to prove the usefulness of these reagents, they were reacted with buckminsterfullerene (C(60)) to give 1-(omega-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes after the deprotection of THP group with TFA. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)02142-x
• 作为产物：
  描述：

  thioacetic acid S-(6-bromohexyl) ester 在 lithium chloride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 生成 (6-Chlor-hexyl)-acetyl-sulfid
  参考文献：
  名称：

  Preparation of ω-tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides: Useful reagents for the synthesis of 1-(ω-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes (C60)

  摘要：

  omega-Tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides are prepared as Grignard reagents containing protected mercaptoalkyl chains, which are useful for the direct introduction of omega-mercaptoalkyl chains to electrophiles. In order to prove the usefulness of these reagents, they were reacted with buckminsterfullerene (C(60)) to give 1-(omega-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes after the deprotection of THP group with TFA. (C) 1998 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(98)02142-x

文献信息

• Boehme,H.; Mencke,B., Archiv der Pharmazie und Berichte der Deutschen Pharmazeutischen Gesellschaft, 1960, vol. 293, p. 54 - 67
  作者：Boehme,H.、Mencke,B.

  DOI：——

  日期：——
• A new versatile synthesis of 4-substituted diaminopyridine derivatives
  作者：Sumela Banerjee、Brigitte Voit、Gert Heinrich、Frank Böhme

  DOI：10.1016/j.tetlet.2012.02.089

  日期：2012.4

  A new convenient method for the synthesis of substituted 2,6-diacetamido pyridines has been developed. It starts from 4-hydroxypyridine and comprises the introduction of the amino groups by the Chichibabin reaction. After several protection and deprotection steps 2,6-diacetamido-4-hydroxy pyridine is obtained, which is regarded as a key compound for the synthesis of various substituted 2,6-diacetamido pyridines. It is shown that the free hydroxy group is susceptible for nucleophilic substitution. This provides an easy access to the introduction of different functional groups at 4-position of 2,6-diacetamido pyridine. The advantages over other procedures described in the literature are discussed. (c) 2012 Elsevier Ltd. All rights reserved.
• Preparation of ω-tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides: Useful reagents for the synthesis of 1-(ω-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes (C60)
  作者：Sung Hoon Kim、Sung Han Lee、Seung Hoon Kang

  DOI：10.1016/s0040-4039(98)02142-x

  日期：1998.12

  omega-Tetrahydropyran-2-ylsulfanylalkylmagnesium chlorides are prepared as Grignard reagents containing protected mercaptoalkyl chains, which are useful for the direct introduction of omega-mercaptoalkyl chains to electrophiles. In order to prove the usefulness of these reagents, they were reacted with buckminsterfullerene (C(60)) to give 1-(omega-mercaptoalkyl)-1,2-dihydrobuckminsterfullerenes after the deprotection of THP group with TFA. (C) 1998 Elsevier Science Ltd. All rights reserved.