(1S,2S,4R,5S)-4-Allyloxy-5-(tert-butyl-dimethyl-silanyloxy)-cyclohexane-1,2-dicarboxylic acid | 508179-69-9

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羟基酸及其衍生物
• 英文名称: (1S,2S,4R,5S)-4-Allyloxy-5-(tert-butyl-dimethyl-silanyloxy)-cyclohexane-1,2-dicarboxylic acid
• CAS: 508179-69-9
• 化学式: C₁₇H₃₀O₆Si
• 分子量: 358.507
• InChiKey: STZYENRQQQPBSU-FQUUOJAGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.14
• 重原子数：
  24.0
• 可旋转键数：
  7.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  93.06
• 氢给体数：
  2.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  四氢吡咯 、 异氰酸苯酯 、 (1S,2S,4R,5S)-4-Allyloxy-5-(tert-butyl-dimethyl-silanyloxy)-cyclohexane-1,2-dicarboxylic acid 生成 、
  参考文献：
  名称：

  Solid-phase synthesis of combinatorial libraries based on enatiomerically pure (1S,2S,4R,5S)-4,5-dihydroxycyclohexan-1,2-dicarboxylic acid scaffolds

  摘要：

  The conditions for solid-phase functionalization of the new enantio-pure scaffold 1 to give libraries of general formula 4 have been derived. (C) 2002 Editions scientifiques et medicales Elsevier SAS. All rights reserved.

  DOI：

  10.1016/s0014-827x(02)01306-x
• 作为产物：
  描述：

  (1S,2S,4R,5S)-4-Allyloxy-5-(tert-butyl-dimethyl-silanyloxy)-cyclohexane-1,2-dicarboxylic acid dimethyl ester 在 lithium hydroxide 作用下， 以 甲醇 为溶剂， 生成 (1S,2S,4R,5S)-4-Allyloxy-5-(tert-butyl-dimethyl-silanyloxy)-cyclohexane-1,2-dicarboxylic acid
  参考文献：
  名称：

  Solid-phase synthesis of combinatorial libraries based on enatiomerically pure (1S,2S,4R,5S)-4,5-dihydroxycyclohexan-1,2-dicarboxylic acid scaffolds

  摘要：

  The conditions for solid-phase functionalization of the new enantio-pure scaffold 1 to give libraries of general formula 4 have been derived. (C) 2002 Editions scientifiques et medicales Elsevier SAS. All rights reserved.

  DOI：

  10.1016/s0014-827x(02)01306-x