10-Butyl-10-aethyl-bicyclo<6.2.0>dec-4-en-9-on | 6108-52-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 10-Butyl-10-aethyl-bicyclo<6.2.0>dec-4-en-9-on
• 英文别名: 10-Aethyl-10-butyl-bicyclo<6.2.0>dec-4-en-9-on；(4Z)-10-butyl-10-ethylbicyclo[6.2.0]dec-4-en-9-one
• CAS: 6108-52-7
• 化学式: C₁₆H₂₆O
• 分子量: 234.382
• InChiKey: RVZGTWBCLCNTMN-SREVYHEPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.81
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  2-乙基己-1-烯-1-酮 、 1,5-cis,cis-cyclooctadiene 反应 8.0h， 生成 10-Butyl-10-aethyl-bicyclo<6.2.0>dec-4-en-9-on
  参考文献：
  名称：

  Ketenes. V. Reactions of Ketenes with Dienes and Olefins¹

  摘要：

  DOI：

  10.1021/jo01023a045

文献信息

• PRETARGETING KIT FOR IMAGING OR THERAPY COMPRISING A TRANS-CYCLOOCTENE DIENOPHILE AND A DIENE
  申请人：Tagworks Pharmaceuticals B.V.

  公开号：EP2707035B1

  公开（公告）日：2020-04-01
• [EN] PRETARGETING KIT FOR IMAGING OR THERAPY COMPRISING A TRANS - CYCLOOCTENE DIENOPHILE AND A DIENE<br/>[FR] TROUSSE DE PRÉ-CIBLAGE POUR L'IMAGERIE OU LA THÉRAPIE COMPORTANT UN DIÉNOPHILE TRANS-CYCLO-OCTÈNE ET UN DIÈNE
  申请人：KONINKL PHILIPS ELECTRONICS NV

  公开号：WO2012153254A1

  公开（公告）日：2012-11-15

  Described is a pretargeting method, and related kits, for targeted medical imaging and/or therapeutics, wherein use is made of abiotic reactive chemical groups that exhibit bio-orthogonal reactivity towards each other. The invention involves the use of [4+2] inverse electron demand (retro) Diels- Alder chemistry in providing the coupling between a Pre-targeting Probe and an Effector Probe. To this end one of these probes comprises an electron-deficient tetrazine or other suitable diene, and the other an E-cyclooctene which has a flattened structure as a result of the position of at least two exocyclic bonds.