(2S,4S)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylhexan-2-ol | 1228243-11-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (2S,4S)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylhexan-2-ol
• CAS: 1228243-11-5
• 化学式: C₁₂H₂₄O₃
• 分子量: 216.321
• InChiKey: KEWXTUTYQFKCNK-UMNHJUIQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  38.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (2S,4S)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylhexan-2-ol 、 叔丁基二甲硅基三氟甲磺酸酯 在 2,6-二甲基吡啶 作用下， 以 二氯甲烷 为溶剂， 以97%的产率得到
  参考文献：
  名称：

  Determination of the absolute configuration of nodulisporacid A by the concise synthesis of four stereoisomers via three-component reaction and one-pot construction of the framework

  摘要：

  Four stereoisomers of nodulisporacid A (1) were synthesized by the concise approach which includes three-component reaction and subsequent one-pot construction of the whole framework. The (1)H NMR comparison of the derivatives (10-12) revealed the absolute configuration of natural 1 to be 4R,4'R,6'R. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.03.064
• 作为产物：
  描述：

  、 甲基锂 在 四氯化锡 作用下， 以 二氯甲烷 为溶剂， 以60%的产率得到(2S,4S)-2-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-4-methylhexan-2-ol
  参考文献：
  名称：

  Determination of the absolute configuration of nodulisporacid A by the concise synthesis of four stereoisomers via three-component reaction and one-pot construction of the framework

  摘要：

  Four stereoisomers of nodulisporacid A (1) were synthesized by the concise approach which includes three-component reaction and subsequent one-pot construction of the whole framework. The (1)H NMR comparison of the derivatives (10-12) revealed the absolute configuration of natural 1 to be 4R,4'R,6'R. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2010.03.064

文献信息

• US9982005B2
  申请人：——

  公开号：US9982005B2

  公开（公告）日：2018-05-29
• Determination of the absolute configuration of nodulisporacid A by the concise synthesis of four stereoisomers via three-component reaction and one-pot construction of the framework
  作者：Tatsunobu Sumiya、Ken Ishigami、Hidenori Watanabe

  DOI：10.1016/j.tetlet.2010.03.064

  日期：2010.5

  Four stereoisomers of nodulisporacid A (1) were synthesized by the concise approach which includes three-component reaction and subsequent one-pot construction of the whole framework. The (1)H NMR comparison of the derivatives (10-12) revealed the absolute configuration of natural 1 to be 4R,4'R,6'R. (C) 2010 Elsevier Ltd. All rights reserved.