2,3-bis(dodecyloxy)benzene-1,4-diyldimethyldiacetate | 198145-94-7

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 2,3-bis(dodecyloxy)benzene-1,4-diyldimethyldiacetate
• 英文别名: 2,3-Bis(dodecyloxy)benzene-1,4-diyldimethyl diacetate；[4-(acetyloxymethyl)-2,3-didodecoxyphenyl]methyl acetate
• CAS: 198145-94-7
• 化学式: C₃₆H₆₂O₆
• 分子量: 590.885
• InChiKey: AWYVBIVVCIDMLR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.4
• 重原子数：
  42
• 可旋转键数：
  30
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  71.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2,3-bis(dodecyloxy)benzene-1,4-diyldimethyldiacetate 在 水 、 potassium carbonate 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 以84%的产率得到2,3-bis(dodecyloxy)benzene-1,4-diyldimethanol
  参考文献：
  名称：

  Bis(1,3-dithiole-2-chalcogenones) and tetrathiafulvalenes in the synthesis of bridged tetrathiafulvalene-containing structures

  摘要：

  Bis(1,3-dithiole-2-chalcogenones) in which the 1,3-dithiole fragments are linked through various bridging groups were synthesized by different methods. Some of these compounds were converted into substituted tetrathiafulvalenes with bridged 1,3-dithiole rings. The same structures were synthesized from preliminarily prepared symmetric tetrathiafulvalenes containing 2-cyanoethylsulfanyl groups in both 1,3-dithiole rings. Similar spacers were used to bridge two tetrathiafulvalene fragments. Syntheses of the involved initial compounds were described.

  DOI：

  10.1134/s1070428007010186
• 作为产物：
  描述：

  4,4'-[2,3-bis(dodecyloxy)benzene-1,4-diyldimethyl]dimorpholine 、 乙酸酐 在 sodium acetate 作用下， 以53%的产率得到2,3-bis(dodecyloxy)benzene-1,4-diyldimethyldiacetate
  参考文献：
  名称：

  Bis(1,3-dithiole-2-chalcogenones) and tetrathiafulvalenes in the synthesis of bridged tetrathiafulvalene-containing structures

  摘要：

  Bis(1,3-dithiole-2-chalcogenones) in which the 1,3-dithiole fragments are linked through various bridging groups were synthesized by different methods. Some of these compounds were converted into substituted tetrathiafulvalenes with bridged 1,3-dithiole rings. The same structures were synthesized from preliminarily prepared symmetric tetrathiafulvalenes containing 2-cyanoethylsulfanyl groups in both 1,3-dithiole rings. Similar spacers were used to bridge two tetrathiafulvalene fragments. Syntheses of the involved initial compounds were described.

  DOI：

  10.1134/s1070428007010186