α-chloroacetophenone | 1612760-70-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: α-chloroacetophenone
• CAS: 1612760-70-9
• 化学式: C₂₂H₂₈F₃N₃O₅S
• 分子量: 503.543
• InChiKey: ZZIJLNRHZKUHOZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.63
• 重原子数：
  34.0
• 可旋转键数：
  15.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  113.6
• 氢给体数：
  3.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  α-chloroacetophenone 在 四氢吡咯 、 四(三苯基膦)钯 作用下， 以 二氯甲烷 为溶剂， 反应 5.5h， 以52.7%的产率得到N-(4-(2-((2-((4-aminobutyl)amino)-2-oxoethyl)thio)acetyl)phenethyl)-2,2,2-trifluoroacetamide
  参考文献：
  名称：

  New photocleavable linker: α-Thioacetophenone-type linker

  摘要：

  Photocleavable linkers are advantageous over the common linkers because they could be cleaved without using reagents. A novel photocleavable linker with an alpha-thioacetophenone moiety has been developed. This linker, which can be cleaved upon irradiation at 365 nm via the Norrish type II reaction, is applicable to a protein affinity purification system, allowing target proteins to be effectively isolated. This novel linker would serve as an effective tool in chemical biology. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.04.104
• 作为产物：
  描述：

  在 三乙基硅烷 、 三乙胺 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 1.67h， 生成 α-chloroacetophenone
  参考文献：
  名称：

  New photocleavable linker: α-Thioacetophenone-type linker

  摘要：

  Photocleavable linkers are advantageous over the common linkers because they could be cleaved without using reagents. A novel photocleavable linker with an alpha-thioacetophenone moiety has been developed. This linker, which can be cleaved upon irradiation at 365 nm via the Norrish type II reaction, is applicable to a protein affinity purification system, allowing target proteins to be effectively isolated. This novel linker would serve as an effective tool in chemical biology. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.04.104