5,6-dihydroxy-2,2,9,9-tetramethyl-4,6-decadiene-3,8-dione | 675844-54-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 5,6-dihydroxy-2,2,9,9-tetramethyl-4,6-decadiene-3,8-dione
• 英文别名: (4Z,6Z)-5,6-dihydroxy-2,2,9,9-tetramethyldeca-4,6-diene-3,8-dione
• CAS: 675844-54-9
• 化学式: C₁₄H₂₂O₄
• 分子量: 254.326
• InChiKey: CNVTVSNMYNWYBJ-XOHWUJONSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  74.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-氨基苯酚 、 5,6-dihydroxy-2,2,9,9-tetramethyl-4,6-decadiene-3,8-dione 在 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 0.07h， 以80%的产率得到2-hydroxy-2-pivaloylmethyl-3-pivaloylmethylene-3,4-dihydro-2H-1,4-benzoxazine
  参考文献：
  名称：

  10.1023/a:1024785902034

  摘要：

  DOI：

  10.1023/a:1024785902034
• 作为产物：
  描述：

  频哪酮 、 草酸二乙酯 在 sodium methylate 作用下， 以 乙醚 为溶剂， 以71%的产率得到(Z)-2-hydroxy-5,5-dimethyl-4-oxo-2-hexenoic acid
  参考文献：
  名称：

  新戊酰丙酮酸作为胺类的新型酰化试剂

  摘要：

  新戊酰丙酮酸是胺类制备性酰化反应的有效试剂。提出了一种合成以 (Z)-β-酮-烯醇互变异构体为主的取代新戊酰丙酮酰胺的方法。讨论了新戊酰丙酮酸及其酰胺的结构，以及新戊酰丙酮酸与胺反应的具体特征。

  DOI：

  10.1007/bf02495160

文献信息

• Chemistry of 2-methylene-2,3-dihydro-3-furanones
  作者：E. N. Kozminykh、N. M. Igidov、G. A. Shavkunova、V. O. Kozminykh

  DOI：10.1007/bf02495929

  日期：1997.7

  2-p-Chlorobenzoylmethylene-5-phenyl-2,3-dihydro-3-furanone reacts with arylamines or N-arylideneamines to form the products of ring opening, 1,6-diaryl-1-arylamino-4-hydroxy-1,4-hexadiene-3,6-diones. The reaction of 5-aryl-2-p-chlorobenzoylmethylene-2,3-dihydro-3-furanones with o-aminophenol afforded 3-p-chlorobenzoylmethylene-3,4-dihydro-2H-benzo[b]-1,4-oxazin-2-one. Nucleophilic attack of amines is directed either to electrophilic centers at the C(5) and C(2) atoms or to the carbonyl group of the 2-phenacylidene substituent of the 3-oxofuran ring.
• ——
  作者：E. S. Berezina、V. O. Koz'minykh、N. M. Igidov、S. S. Shirinkina、E. N. Koz'minykh、R. R. Makhmudov、E. V. Bukanova

  DOI：10.1023/a:1012486020067

  日期：——

  Pivaloylpyruvamides were obtained by reaction of pivaloylpyruvic acid with ammonia, primary and secondary amines. The amides in solutions exist as an equilibrium tautomeric mixture of ketoenol and minor beta -diketone forms. The pivaloylpyruvamides under mild conditions react with benzylamine or arylamines to furnish products of substitution at the alpha -carbonyl group, the corresponding amides of (Z)-2-benzylamino- or 2-arylamino-5,5-dimethyl-4-oxo-2-hexenoic acid. The latter also exist in solutions as two tautomers. The amides synthesized possess a biological activity.
• Pivaloylpyruvic acid as a new acylating reagent for amines
  作者：V. O. Koz'minykh、N. M. Igidov、E. S. Berezina、E. N. Koz'minykh、Yu. S. Kasatkina

  DOI：10.1007/bf02495160

  日期：2000.9

  Pivaloylpyruvic acid is an efficient reagent for preparative acylation of amines. A method for the synthesis of substituted pivaloylpyruvamides with domination of (Z)-β-keto-enol tautomer is proposed. The structure of pivaloylpyruvic acid and its amides, as well as the specific features of the reaction of pivaloylpyruvic acid with amines, are discussed.

  新戊酰丙酮酸是胺类制备性酰化反应的有效试剂。提出了一种合成以 (Z)-β-酮-烯醇互变异构体为主的取代新戊酰丙酮酰胺的方法。讨论了新戊酰丙酮酸及其酰胺的结构，以及新戊酰丙酮酸与胺反应的具体特征。
• 10.1023/a:1024785902034
  作者：Kozminykh、Igidov、Kozminykh

  DOI：10.1023/a:1024785902034

  日期：——