| 1191236-46-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1191236-46-0
• 化学式: C₃₇H₅₈O₁₃Si
• 分子量: 738.945
• InChiKey: SJEAPLBWRMLLSC-BWNGVVAGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.38
• 重原子数：
  51.0
• 可旋转键数：
  11.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  135.67
• 氢给体数：
  0.0
• 氢受体数：
  13.0

反应信息

• 作为反应物：
  描述：

  在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 以74%的产率得到[(4R,5S)-5-[(4S,5R)-2,2-dimethyl-5-phenylmethoxycarbonyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]methyl (4R,5S)-5-[(4S,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate
  参考文献：
  名称：

  Cyclic oligomers (macroaldonolactones) from a protected d-galactonic acid monomer

  摘要：

  Dicyclohexylcarbodiimide-promoted self-condensation of 2,3:4,5-di-O-isopropylidene-D-galactonic acid (3) led to the macrocyclic oligomeric cyclo[(2,3:4,5-di-O-isopropylidene-(1 -> 6)-D-galactonate)(2)] (4) and cyclo[(2,3:4,5-di-O-isopropylidene-(1 -> 6)-D-galactonate)(3)] (5), having, respectively, 14- and 21-membered rings. The macrocycles 4 and 5 were also synthesized by cyclization of the respective linear dinner 11 and trimer 14 omega-hydroxy acids precursors prepared by stepwise additions of 3. Compounds 4 and 5 are biomaterials that may be described as macrolactone-cyclodextrins. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.07.123
• 作为产物：
  描述：

  benzyl (4R,5S)-5-[(4S,5R)-5-(hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolane-4-carboxylate 、 (4R,5S)-5-[(4S,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolane-4-carboxylic acid 在 4-二甲氨基吡啶 、 4-(dimethylamino)pyridinium trifluoroacetate 、 N,N'-二环己基碳二亚胺 作用下， 以 氯仿 为溶剂， 以72%的产率得到
  参考文献：
  名称：

  Cyclic oligomers (macroaldonolactones) from a protected d-galactonic acid monomer

  摘要：

  Dicyclohexylcarbodiimide-promoted self-condensation of 2,3:4,5-di-O-isopropylidene-D-galactonic acid (3) led to the macrocyclic oligomeric cyclo[(2,3:4,5-di-O-isopropylidene-(1 -> 6)-D-galactonate)(2)] (4) and cyclo[(2,3:4,5-di-O-isopropylidene-(1 -> 6)-D-galactonate)(3)] (5), having, respectively, 14- and 21-membered rings. The macrocycles 4 and 5 were also synthesized by cyclization of the respective linear dinner 11 and trimer 14 omega-hydroxy acids precursors prepared by stepwise additions of 3. Compounds 4 and 5 are biomaterials that may be described as macrolactone-cyclodextrins. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2009.07.123