(E)-3-ethyl-1-phenylhept-1-en-4-one | 1393444-53-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: (E)-3-ethyl-1-phenylhept-1-en-4-one
• CAS: 1393444-53-5
• 化学式: C₁₅H₂₀O
• 分子量: 216.323
• InChiKey: DDOOOTXHIKYFPQ-VAWYXSNFSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  16
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 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：

  (E)-3-ethyl-1-phenylhept-1-en-4-one 在 盐酸羟胺 、 水 作用下， 以 二甲基亚砜 为溶剂， 反应 1.5h， 生成
  参考文献：
  名称：

  A One-Pot Approach to Δ²-Isoxazolines from Ketones and Arylacetylenes

  摘要：

  The sequential reaction of ketones with arylacetylenes and hydroxylamine in the presence of KOBut/DMSO followed by the treatment of the reaction mixture with H2O and KOH leads to Delta(2)-isoxazolines in up to 88% yield.

  DOI：

  10.1021/ol303132u
• 作为产物：
  描述：

  4-庚酮 、 苯乙炔 在 potassium tert-butylate 作用下， 以 二甲基亚砜 为溶剂， 反应 0.5h， 以91%的产率得到(E)-3-ethyl-1-phenylhept-1-en-4-one
  参考文献：
  名称：

  Transition-Metal-Free Superbase-Promoted Stereoselective α-Vinylation of Ketones with Arylacetylenes: A General Strategy for Synthesis of β,γ-Unsaturated Ketones

  摘要：

  A wide variety of beta,gamma-unsaturated ketones of E configuration have been obtained in good to excellent yields via (KOBu)-Bu-t/DMSO promoted alpha-vinylation of aliphatic, cycloaliphatic, and alkyl aromatic (heteroaromatic) ketones with diverse arylacetylenes.

  DOI：

  10.1021/jo301005p

文献信息

• Nickel/Photo-Cocatalyzed C(sp²)–H Allylation of Aldehydes and Formamides
  作者：Pei Fan、Rui Wang、Chuan Wang

  DOI：10.1021/acs.orglett.1c02938

  日期：2021.10.1

  nickel/photo-cocatalyzed C(sp2)–H allylation of aldehydes and formamides wherein both allyl acetates and allyl alcohols can be used as the allylating agents. In this reaction, radical-type umpolung of the formyl moiety is enabled by tetrabutylammonium decatungstate as a hydrogen-atom-transfer photocatalyst, whereas nickel serves to cleave the C–O bond of allyl acetates or allyl alcohols. The synergistic effect

  在此，我们报告了一种镍/光共催化的醛和甲酰胺的C(sp 2 )-H 烯丙基化，其中乙酸烯丙酯和烯丙醇均可用作烯丙基化剂。在该反应中，四丁基十钨酸铵作为氢原子转移光催化剂实现了甲酰基部分的自由基型聚合，而镍则用于裂解乙酸烯丙酯或烯丙醇的 C-O 键。这两种催化剂的协同作用为获得各种具有高选择性的 β,γ-不饱和酮和酰胺提供了新的途径。
• Transition-Metal-Free Superbase-Promoted Stereoselective α-Vinylation of Ketones with Arylacetylenes: A General Strategy for Synthesis of β,γ-Unsaturated Ketones
  作者：Boris A. Trofimov、Elena Yu. Schmidt、Nadezhda V. Zorina、Elena V. Ivanova、Igor' A. Ushakov

  DOI：10.1021/jo301005p

  日期：2012.8.17

  A wide variety of beta,gamma-unsaturated ketones of E configuration have been obtained in good to excellent yields via (KOBu)-Bu-t/DMSO promoted alpha-vinylation of aliphatic, cycloaliphatic, and alkyl aromatic (heteroaromatic) ketones with diverse arylacetylenes.
• A One-Pot Approach to Δ²-Isoxazolines from Ketones and Arylacetylenes
  作者：Elena Yu. Schmidt、Inna V. Tatarinova、Elena V. Ivanova、Nadezhda V. Zorina、Igor’ A. Ushakov、Boris A. Trofimov

  DOI：10.1021/ol303132u

  日期：2013.1.4

  The sequential reaction of ketones with arylacetylenes and hydroxylamine in the presence of KOBut/DMSO followed by the treatment of the reaction mixture with H2O and KOH leads to Delta(2)-isoxazolines in up to 88% yield.