4-acetoxy-1-chloro-butan-2-one | 61955-88-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-acetoxy-1-chloro-butan-2-one
• 英文别名: 4-Acetoxy-1-chlor-butan-2-on；4-Acetoxy-1-chloro-2-butanon；2-Butanone, 4-(acetyloxy)-1-chloro-；(4-chloro-3-oxobutyl) acetate
• CAS: 61955-88-2
• 化学式: C₆H₉ClO₃
• mdl: MFCD18813409
• 分子量: 164.589
• InChiKey: KHQRHTUBTJVFQE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  10
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.666
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

安全信息

• 海关编码：
  2915390090

反应信息

• 作为反应物：
  描述：

  4-acetoxy-1-chloro-butan-2-one 在 potassium hydrogensulfate 作用下， 150.0 ℃ 、4.0 kPa 条件下， 生成 1-chloro-3-buten-2-one
  参考文献：
  名称：

  Simplified syntheses of polymerizable bis-substituted phosphatidylcholines with various chain lengths

  摘要：

  Syntheses of new compounds, 1,2-bis[15-(2',4'-hexadienoyloxy)pentadecanoyl]- and 1,2-bis[15-(2',4'hexadienoyloxy)dodecanoyl]-sn-glycero-3- via a simplified procedure are reported. The new approach utilizes the conversion of commercially available lactones into polymerizable bis-substituted phosphatidylcholines after two steps of reaction. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)01537-9
• 作为产物：
  描述：

  1,4-二氯丁烷-2-酮 、 溶剂黄146 在 potassium acetate 作用下， 生成 4-acetoxy-1-chloro-butan-2-one
  参考文献：
  名称：

  Simplified syntheses of polymerizable bis-substituted phosphatidylcholines with various chain lengths

  摘要：

  Syntheses of new compounds, 1,2-bis[15-(2',4'-hexadienoyloxy)pentadecanoyl]- and 1,2-bis[15-(2',4'hexadienoyloxy)dodecanoyl]-sn-glycero-3- via a simplified procedure are reported. The new approach utilizes the conversion of commercially available lactones into polymerizable bis-substituted phosphatidylcholines after two steps of reaction. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(00)01537-9

文献信息

• Rosnati,V. et al., Gazzetta Chimica Italiana, 1976, vol. 106, p. 633 - 640
  作者：Rosnati,V. et al.

  DOI：——

  日期：——
• Simplified syntheses of polymerizable bis-substituted phosphatidylcholines with various chain lengths
  作者：Soo K. Bae、Se-H. Kim、Jong-D. Kim、Kyo I. Koo、Tai K. Ryeom、Kon Ryeom、Xiaolin Fu、Young H. Chang

  DOI：10.1016/s0040-4039(00)01537-9

  日期：2000.10

  Syntheses of new compounds, 1,2-bis[15-(2',4'-hexadienoyloxy)pentadecanoyl]- and 1,2-bis[15-(2',4'hexadienoyloxy)dodecanoyl]-sn-glycero-3- via a simplified procedure are reported. The new approach utilizes the conversion of commercially available lactones into polymerizable bis-substituted phosphatidylcholines after two steps of reaction. (C) 2000 Elsevier Science Ltd. All rights reserved.