(1R,3aR,7aS)-7a-methyl-2,3,3a,6,7,7a-hexahydro-(1H)-indene-1,3a-diol | 1013330-33-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (1R,3aR,7aS)-7a-methyl-2,3,3a,6,7,7a-hexahydro-(1H)-indene-1,3a-diol
• 英文别名: (1R,3aR,7aS)-7a-methyl-2,3,6,7-tetrahydro-1H-indene-1,3a-diol
• CAS: 1013330-33-0
• 化学式: C₁₀H₁₆O₂
• 分子量: 168.236
• InChiKey: GMALDRARHZLKHD-UTLUCORTSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (1R,3aR,7aS)-7a-methyl-2,3,3a,6,7,7a-hexahydro-(1H)-indene-1,3a-diol 、 对甲苯磺酰氯 在 吡啶 作用下， 反应 20.0h， 以75%的产率得到(1R,3aR,7aS)-3a-hydroxy-7a-methyl-2,3,3a,6,7,7a-hexahydro-(1H)-inden-1-yl 4-methylbenzenesulfonate
  参考文献：
  名称：

  An Unconventional Approach to the Enantioselective Synthesis of Caryophylloids

  摘要：

  The chiral enones 4 and ent-4 have been synthesized enantiomerically as configurationally stable compounds that can be used for the synthesis of caryophylloids. For instance, ent-4 has been converted to the marine natural product coraxeniolide A.

  DOI：

  10.1021/ja8003705
• 作为产物：
  描述：

  C₁₃H₂₄O₂Si 在 triethylamine tris(hydrogen fluoride) 作用下， 以 四氢呋喃 为溶剂， 反应 2.0h， 以0.69 g的产率得到(1R,3aR,7aS)-7a-methyl-2,3,3a,6,7,7a-hexahydro-(1H)-indene-1,3a-diol
  参考文献：
  名称：

  An Unconventional Approach to the Enantioselective Synthesis of Caryophylloids

  摘要：

  The chiral enones 4 and ent-4 have been synthesized enantiomerically as configurationally stable compounds that can be used for the synthesis of caryophylloids. For instance, ent-4 has been converted to the marine natural product coraxeniolide A.

  DOI：

  10.1021/ja8003705

文献信息

• An Unconventional Approach to the Enantioselective Synthesis of Caryophylloids
  作者：Oleg V. Larionov、E. J. Corey

  DOI：10.1021/ja8003705

  日期：2008.3.1

  The chiral enones 4 and ent-4 have been synthesized enantiomerically as configurationally stable compounds that can be used for the synthesis of caryophylloids. For instance, ent-4 has been converted to the marine natural product coraxeniolide A.