6-(pent-4-en-1-yloxy)hexan-1-ol | 1236827-35-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 6-(pent-4-en-1-yloxy)hexan-1-ol
• CAS: 1236827-35-2
• 化学式: C₁₁H₂₂O₂
• 分子量: 186.294
• InChiKey: MXDMSKFLBFZNRF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.52
• 重原子数：
  13.0
• 可旋转键数：
  10.0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  29.46
• 氢给体数：
  1.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  6-(pent-4-en-1-yloxy)hexan-1-ol 、 对甲苯磺酰氯 在 4-二甲氨基吡啶 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 以84%的产率得到6-(pent-4-en-1-yloxy)hexyl 4-methylbenzenesulfonate
  参考文献：
  名称：

  Synthesis of Small and Large Fused Bicyclic Compounds by Tandem Dienyne Ring-Closing Metathesis

  摘要：

  A tandem ring-closing metathesis reaction using ruthenium catalyst was carried out to synthesize various fused bicyclic compounds containing both small and large rings. Fast ring-closure of the small ring and slow ring-closure of the large ring resulted in the formation of only one Isomer. Further manipulation such as the Diels-Alder reaction was carried out to prepare a complex molecule containing multiple rings of different sizes.

  DOI：

  10.1021/ol101233k
• 作为产物：
  描述：

  1,6-己二醇 、 5-溴-1-戊烯 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 以54%的产率得到6-(pent-4-en-1-yloxy)hexan-1-ol
  参考文献：
  名称：

  Synthesis of Small and Large Fused Bicyclic Compounds by Tandem Dienyne Ring-Closing Metathesis

  摘要：

  A tandem ring-closing metathesis reaction using ruthenium catalyst was carried out to synthesize various fused bicyclic compounds containing both small and large rings. Fast ring-closure of the small ring and slow ring-closure of the large ring resulted in the formation of only one Isomer. Further manipulation such as the Diels-Alder reaction was carried out to prepare a complex molecule containing multiple rings of different sizes.

  DOI：

  10.1021/ol101233k