(1S,4S)-3-[2-(Dimethyl-hydrazono)-eth-(Z)-ylidene]-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-one | 178326-86-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: (1S,4S)-3-[2-(Dimethyl-hydrazono)-eth-(Z)-ylidene]-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-one
• CAS: 178326-86-8
• 化学式: C₁₅H₂₄N₂OS
• 分子量: 280.434
• InChiKey: QJOAJCDSGBRDQR-UBFLHSSISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.83
• 重原子数：
  19.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  32.67
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  (1S,4S)-3-[2-(Dimethyl-hydrazono)-eth-(Z)-ylidene]-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-one 在 sodium tetrahydroborate 作用下， 以 乙醇 、 水 为溶剂， 以91%的产率得到(1S,4S)-3-[2-(Dimethyl-hydrazono)-eth-(Z)-ylidene]-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-ol
  参考文献：
  名称：

  Synthesis of homochiral camphor annulated pyrrole derivatives

  摘要：

  Two new derivatives of camphor annulated to pyrrole have been synthesized representing potentially useful mono- and bidentate chiral ligands. A new method for the cleavage of the NN bond in 1-(dimethylamino)pyrroles is described. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0957-4166(96)00140-1
• 作为产物：
  描述：

  glyoxal mono-N,N-dimethylhydrazone 、 (1S,4R)-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-one 在 lithium diisopropyl amide 作用下， 生成 (1S,4S)-3-[2-(Dimethyl-hydrazono)-eth-(Z)-ylidene]-7,7-dimethyl-1-methylsulfanylmethyl-bicyclo[2.2.1]heptan-2-one 、
  参考文献：
  名称：

  Synthesis of homochiral camphor annulated pyrrole derivatives

  摘要：

  Two new derivatives of camphor annulated to pyrrole have been synthesized representing potentially useful mono- and bidentate chiral ligands. A new method for the cleavage of the NN bond in 1-(dimethylamino)pyrroles is described. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0957-4166(96)00140-1