9-乙基-二环[4,3,0]壬-1(9)-烯-8-酮 | 39163-32-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 9-乙基-二环[4,3,0]壬-1(9)-烯-8-酮
• 英文名称: 9-ethyl-bicyclo[4,3,0]non-1(9)-en-8-one
• 英文别名: 9-ethylbicyclo[4,3,0]nona-1(9)-en-8-one；3-Ethyl-1,4,5,6,7,7a-hexahydroinden-2-one
• CAS: 39163-32-1
• 化学式: C₁₁H₁₆O
• 分子量: 164.247
• InChiKey: IVDMJTOUIQUUKK-UHFFFAOYSA-N

物化性质

• 沸点：
  272.4±7.0 °C(Predicted)
• 密度：
  1.00±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  9-乙基-二环[4,3,0]壬-1(9)-烯-8-酮 在 PPA 作用下， 生成 1-乙基茚满
  参考文献：
  名称：

  Ficini,J.; Maujean,A., Bulletin de la Societe Chimique de France, 1972, p. 4392 - 4395

  摘要：

  DOI：
• 作为产物：
  描述：

  ethyl-1 hydrinden-8,9 one-2 生成 9-乙基-二环[4,3,0]壬-1(9)-烯-8-酮
  参考文献：
  名称：

  FREJAVILLE, C.;JULLIEN, R.;STAHL-LARIVIERE, H.;WANAT, M.;ZANN, D., TETRAHEDRON, 1982, 38, N 17, 2671-2679

  摘要：

  DOI：

文献信息

• Crosslink-cyclized cyclopentadiene and dihalobis type metal compound containing same as ligand
  申请人：——

  公开号：US20010012902A1

  公开（公告）日：2001-08-09

  A process for producing a crosslink-cyclized cyclopentadiene, comprising the steps of reacting a cyclopentenone with an alkali metal hydride to thereby reduce the cyclopentenone (reduction step A) into a cyclopentenol; and reacting the cyclopentenol with a dehydrating agent to thereby dehydrate the cyclopentenol (dehydration step B) into a crosslink-cyclized cyclopentadiene of the general formula (III): 1 wherein each of R 1 and R 2 independently represents a hydrogen atom or a linear or branched saturated alkyl group having 1 to 6 carbon atoms, n is an integer of 3 to 10, and the broken line in the 5-membered ring denotes that the 5-membered ring has two double bonds.

  一种生产交联环化环戊二烯的方法，包括以下步骤：将环戊酮与碱金属氢化物反应，从而还原环戊酮（还原步骤A）成为环戊醇；将环戊醇与脱水剂反应，从而脱水环戊醇（脱水步骤B）成为通式（III）的交联环化环戊二烯：其中，R1和R2各自独立地表示氢原子或具有1至6个碳原子的线性或支链饱和烷基，n是3至10的整数，5元环中的断裂线表示5元环有两个双键。
• Process for the preparation of condensed cyclopentadiene derivatives, 1, 3 disubstituted derivatives and metallocene type compounds containing them as ligand
  申请人：HONSHU CHEMICAL INDUSTRY CO. LTD.

  公开号：EP1122229A1

  公开（公告）日：2001-08-08

  A process for producing a crosslink-cyclized cyclopentadiene, comprising the steps of reacting a cyclopentenone with an alkali metal hydride to thereby reduce the cyclopentenone (reduction step A) into a cyclopentenol; and reacting the cyclopentenol with a dehydrating agent to thereby dehydrate the cyclopentenol (dehydration step B) into a crosslink-cyclized cyclopentadiene of the general formula (III):    wherein each of R1 and R2 independently represents a hydrogen atom or a linear or branched saturated alkyl group having 1 to 6 carbon atoms, n is an integer of 3 to 10, and the broken line in the 5-membered ring denotes that the 5-membered ring has two double bonds.

  一种生产横链环化环戊二烯的工艺，包括以下步骤：将环戊烯酮与碱金属氢化物反应，从而将环戊烯酮还原（还原步骤 A）为环戊烯醇；以及将环戊烯醇与脱水剂反应，从而将环戊烯醇脱水（脱水步骤 B）为通式(III)的横链环化环戊二烯： 其中 R1 和 R2 各自独立地代表氢原子或具有 1 至 6 个碳原子的直链或支链饱和烷基，n 为 3 至 10 的整数，5 元环中的折线表示 5 元环具有两个双键。
• Access to Functionalized Bicyclo[4,3,0]nonenes via Palladium-Catalyzed Oxidative Cyclization of 2-Allylcyclohexyl Oximes
  作者：Jia-Liang Zhu、Sih-Ting Wu、Jr-Yun Shie

  DOI：10.1021/jo5005422

  日期：2014.4.18

  A new palladium-catalyzed oxidative cyclization process leading to the functionalized bicyclo[4,3,0]nonenes is serendipitously discovered during attempts to form azaheterocycle by the amino-Heck reaction of trans-2-vinyl-clohexyl phosphinyloxime. Under the influence of Pd(dba)(2)/Et3N/1:1 N-2-O-2 (1:1, v/v) (Method A) or Pd(OAc)(2)/Et3N/O-2 (Method B), the reactions afford the substituted cis-1-hydroxyl-8-formyl-bicyclo[4,3,0]non-8(9)-enes or bicycle[4,3,0]non-1(9)-en-8-ones in varying yields with the incorporation of molecular oxygen into the structures. The 5,6-bicyclic scaffold of these products is presumably derived from tandem double intramolecular cyclization followed by the ring-opening of an aza-palladium(II) tricyclic intermediate.
• Access to diversely α-substituted cyclopentenones from α-chlorocyclopentenones
  作者：Audrey Giannini、Yoann Coquerel、Andrew E. Greene、Jean-Pierre Deprés

  DOI：10.1016/j.tetlet.2004.07.049

  日期：2004.8

  alpha-Chlorocyclopentenones can readily be transformed into a variety of alpha-substituted cyclopentenones via their dimethyltrimethylene acetals. (C) 2004 Elsevier Ltd. All rights reserved.
• US6482966B2
  申请人：——

  公开号：US6482966B2

  公开（公告）日：2002-11-19