(Z)-ethyl 3,5-dimethyl-2-hexenoate | 82351-62-0

• 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: (Z)-ethyl 3,5-dimethyl-2-hexenoate
• 英文别名: ethyl (Z)-3,5-dimethylhex-2-enoate；(2Z)-ethyl 3,5-dimethyl-2-hexenoate；(Z)-ethyl 3,5-dimethylhex-2-enoate
• CAS: 82351-62-0
• 化学式: C₁₀H₁₈O₂
• 分子量: 170.252
• InChiKey: JZDBQUQHLAWUMT-CLFYSBASSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  12
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (Z)-ethyl 3,5-dimethyl-2-hexenoate 在 lithium aluminium tetrahydride 、 三氯化铝 作用下， 以 乙醚 为溶剂， 反应 2.0h， 以70%的产率得到(Z)-3,5-Dimethyl-hex-2-en-1-ol
  参考文献：
  名称：

  Kelkar, S V; Reddy, G Bhaskar; Kulkarni, G H, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1991, vol. 30, # 5, p. 504 - 507

  摘要：

  DOI：
• 作为产物：
  描述：

  磷酰基乙酸三乙酯 、 4-甲基-2-戊酮 在 sodium hydride 作用下， 以 乙醚 为溶剂， 以67%的产率得到(Z)-ethyl 3,5-dimethyl-2-hexenoate
  参考文献：
  名称：

  Kelkar, S V; Reddy, G Bhaskar; Kulkarni, G H, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1991, vol. 30, # 5, p. 504 - 507

  摘要：

  DOI：

文献信息

• Synthetic Method to Form 2,2′-Bis(naphthoquinone) Compounds
  作者：Vishwajeet Jha、Navneet Goyal、Cheryl K. Stevens、Edwin Stevens、Jayalakshmi Sridhar

  DOI：10.1021/acs.joc.7b02501

  日期：2017.12.15

  We have discovered a transition-metal-free approach to the synthesis of 2,2′-bis(naphthoquinones) using a Diels–Alder reaction of conjugated ketene silyl acetals with benzoquinone. Its monomer analogue can also be synthesized by simply increasing the equivalents of benzoquinone.

  我们发现，使用共轭乙烯酮甲硅烷基缩醛与苯醌的Diels-Alder反应，可以使用无过渡金属的方法合成2,2'-双（萘醌）。它的单体类似物也可以通过简单地增加苯醌的当量来合成。
• [EN] HOMOALLYL ALCOHOLS USEFUL AS FRAGRANCES<br/>[FR] ALCOOLS HOMOALLYLIQUES CONVENANT COMME PARFUMS
  申请人：GIVAUDAN SA

  公开号：WO2009065244A1

  公开（公告）日：2009-05-28

  Branched, highly-substituted C9-C13 homoallyl alcohols of formula (I) in which R1 and R2 are selected from H or Me and R3 is selected from H, Me and Et. The compounds are useful in fragrance applications in which a floral note is desired.

  公式（I）中R1和R2从H或Me中选择，R3从H，Me和Et中选择的分支，高度取代的C9-C13同烯基醇。这些化合物在需要花香调的香精应用中很有用。
• A Flexible Route toward Polypropylene Model Compounds of Various Tacticities
  作者：Jacqueline Marchand-Brynaert、Xavier Drooghaag、Gaëtan Henry

  DOI：10.1055/s-0030-1258233

  日期：2010.11

  paper reports the flexible synthesis of 2,4,6,8,10-pentamethylundecane (PMU) as well as a chromatographic method for the separation of its diastereoisomers. This strategy offers a unique opportunity to accede to three model compounds of polypropylene (PP) of different tacticities (i.e., isotactic, syndiotactic, and atactic PP). model hydrocarbons - polyolefins - total synthesis - HPLC - NMR

  本文报道了2,4,6,8,10-五甲基十一烷（PMU）的灵活合成方法以及其非对映异构体分离的色谱方法。该策略提供了独特的机会来加入三种具有不同立规度（即等规，间规和无规PP）的聚丙烯（PP）模型化合物。 模型烃-聚烯烃-全合成-HPLC-NMR
• Esterase-mediated synthesis of optically active GABA analogues containing a stereogenic all-carbon quaternary carbon atom
  作者：Fulvia Felluga、Franco Ghelfi、Giuliana Pitacco、Fabrizio Roncaglia、Ennio Valentin、Cesare Daniele Venneri

  DOI：10.1016/j.tetasy.2010.07.010

  日期：2010.9

  Esterase from Horse Liver (HLAP) was able to hydrolyze a series of linear and cyclic beta,beta-dialkyl-gamma-nitroesters, in spite of the well-known reluctance of hydrolytic enzymes to recognize and transform hindered substrates, such as those possessing a stereogenic quaternary carbon atom next to the reaction site. The resulting optically active gamma-nitroesters gave access to optically active beta,beta-disubstituted gamma-aminoacids as well as alpha,alpha-disubstituted succinic acids, both being biologically relevant compounds. (C) 2010 Elsevier Ltd. All rights reserved.
• Synthesis and absolute configuration of (R)-(+)- and (S)-(-)-5-(1,3-dimethylbutyl)-5-ethylbarbituric acid
  作者：Kenner C. Rice

  DOI：10.1021/jo00140a004

  日期：1982.9