Ethyltricyclo[8.2.2.2(4,7)]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-yl-amine | 146271-15-0

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: Ethyltricyclo[8.2.2.2(4,7)]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-yl-amine
• 英文别名: N-ethyltricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-amine
• CAS: 146271-15-0
• 化学式: C₁₈H₂₁N
• 分子量: 251.371
• InChiKey: RUCXDZFAUSHVJV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  12
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  Ethyltricyclo[8.2.2.2(4,7)]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-yl-amine 以 乙腈 为溶剂， 生成
  参考文献：
  名称：

  5-deazaflavinocyclophane as a novel flavoenzyme model. Synthesis and diastereoface-differentiating reactions

  摘要：

  New 5-deazaflavinocyclophane with planar chirality, a novel flavoenzyme model, has been synthesized. This compound provides the first example for selective diastereoface-differentiation during its own reduction and oxidation.

  DOI：

  10.1016/0957-4166(92)80013-m
• 作为产物：
  描述：

  4-nitro[2.2]paracyclophane 在 platinum(IV) oxide sodium tetrahydroborate 、 氢气 、 对甲苯磺酸 作用下， 以 甲醇 为溶剂， 生成 Ethyltricyclo[8.2.2.2(4,7)]hexadeca-1(13),4,6,10(14),11,15-hexaen-5-yl-amine
  参考文献：
  名称：

  5-deazaflavinocyclophane as a novel flavoenzyme model. Synthesis and diastereoface-differentiating reactions

  摘要：

  New 5-deazaflavinocyclophane with planar chirality, a novel flavoenzyme model, has been synthesized. This compound provides the first example for selective diastereoface-differentiation during its own reduction and oxidation.

  DOI：

  10.1016/0957-4166(92)80013-m