Ethyl-[2-(morpholin-4-yl)-6-oxocyclohex-1-en-1-yl]carbonat | 70989-98-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: Ethyl-[2-(morpholin-4-yl)-6-oxocyclohex-1-en-1-yl]carbonat
• 英文别名: 2-ethoxycarbonyloxy-3-morpholin-4-yl-cyclohex-2-enone；ethyl (2-morpholin-4-yl-6-oxocyclohexen-1-yl) carbonate
• CAS: 70989-98-9
• 化学式: C₁₃H₁₉NO₅
• 分子量: 269.298
• InChiKey: OINUVEKXCGHNFC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.46
• 重原子数：
  19.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  65.07
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  Ethyl-[2-(morpholin-4-yl)-6-oxocyclohex-1-en-1-yl]carbonat 以 二氯甲烷 为溶剂， 生成 3-hydroxy-3-(1-methoxy-2,6-dioxocyclohexyl)spiro[5.5]undecan-2,4-dion
  参考文献：
  名称：

  Chemie freier cyclischer vicinaler Tricarbonyl-Verbindungen (‘1,2,3-Trione') Teil 2. Redox-Reaktionen von 1,2,3-Trionen mit En-1,2-diolen (‘Reduktonen'), 2-Alkoxy-en-1-olen, En-1,2-diaminen und verwandten Spezies Für Teil 1, s. [1].

  摘要：

  Chemistry of Free Cyclic Vicinal Tricarbonyl Compounds ('1,2,3-Triones'). Part 2. Redox Reactions of 1,2,3-Triones with Ene-1,2-diols ('Reductones'), 2-Alkoxy-en-1-ols, Ene-1,2-diamines, and Related SpeciesMidstanding carbonyl groups of cyclic 1,2,3-triones 4 possess outstanding electrophilic (elcctron-pair accepting) as well as oxidizing (one-electron accepting) properties. Their reactions with selected electron-rich C C bonds as efficient nucleophiles (AN reactions) and as efficient reducing agents (SET (single electron transfer) reactions) are studied. In a few cases, short-lived charge-transfer colors could be observed. Particularly, free didehydro-5,6-0-isopropyliden-L-ascorbic acid (4g), its 0,C-adduct 8g to 5,6-O-isopropylidene-(L)-ascorbic acid (1g), and - via an independent pathway - the ostensible C,C-dimer 10a of mono-dehydrodimedone reductone were prepared. Intermediate radical anions 4- can be considered to be ideal representatives of dicapto-dative radicals. Novel large-scale syntheses of 3,4-dihydroxyfuran-2(5H)-one (1e) and of its vicinal trione 4e are presented.

  DOI：

  10.1002/1522-2675(200205)85:5<1295::aid-hlca1295>3.0.co;2-k
• 作为产物：
  描述：

  3-morpholin-4-yl-cyclohex-2-enone 、 alkaline earth salt of/the/ methylsulfuric acid 以40%的产率得到Ethyl-[2-(morpholin-4-yl)-6-oxocyclohex-1-en-1-yl]carbonat
  参考文献：
  名称：

  Chemie freier cyclischer vicinaler Tricarbonyl-Verbindungen (‘1,2,3-Trione') Teil 2. Redox-Reaktionen von 1,2,3-Trionen mit En-1,2-diolen (‘Reduktonen'), 2-Alkoxy-en-1-olen, En-1,2-diaminen und verwandten Spezies Für Teil 1, s. [1].

  摘要：

  Chemistry of Free Cyclic Vicinal Tricarbonyl Compounds ('1,2,3-Triones'). Part 2. Redox Reactions of 1,2,3-Triones with Ene-1,2-diols ('Reductones'), 2-Alkoxy-en-1-ols, Ene-1,2-diamines, and Related SpeciesMidstanding carbonyl groups of cyclic 1,2,3-triones 4 possess outstanding electrophilic (elcctron-pair accepting) as well as oxidizing (one-electron accepting) properties. Their reactions with selected electron-rich C C bonds as efficient nucleophiles (AN reactions) and as efficient reducing agents (SET (single electron transfer) reactions) are studied. In a few cases, short-lived charge-transfer colors could be observed. Particularly, free didehydro-5,6-0-isopropyliden-L-ascorbic acid (4g), its 0,C-adduct 8g to 5,6-O-isopropylidene-(L)-ascorbic acid (1g), and - via an independent pathway - the ostensible C,C-dimer 10a of mono-dehydrodimedone reductone were prepared. Intermediate radical anions 4- can be considered to be ideal representatives of dicapto-dative radicals. Novel large-scale syntheses of 3,4-dihydroxyfuran-2(5H)-one (1e) and of its vicinal trione 4e are presented.

  DOI：

  10.1002/1522-2675(200205)85:5<1295::aid-hlca1295>3.0.co;2-k

文献信息

• Adler,M. et al., Chemische Berichte, 1979, vol. 112, p. 2314 - 2323
  作者：Adler,M. et al.

  DOI：——

  日期：——
• Adler,M. et al., Chemische Berichte, 1979, vol. 112, p. 2324 - 2331
  作者：Adler,M. et al.

  DOI：——

  日期：——
• ADLER M.; SCHANK K.; SCHMIDT V., CHEM. BER., 1979, 112, NO 6, 2314-2323,
  作者：ADLER M.、 SCHANK K.、 SCHMIDT V.

  DOI：——

  日期：——
• ALDER M.; SCHANK K.; SCHMIDT V., CHEM. BER., 1979, 112, NO 6, 2324-2331
  作者：ALDER M.、 SCHANK K.、 SCHMIDT V.

  DOI：——

  日期：——