Hexan-1,3,6-tricarbonsaeure-trimethylester | 17219-19-1

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: Hexan-1,3,6-tricarbonsaeure-trimethylester
• 英文别名: hexane-1,3,6-tricarboxylic acid trimethyl ester；Trimethyl hexane-1,3,6-tricarboxylate
• CAS: 17219-19-1
• 化学式: C₁₂H₂₀O₆
• 分子量: 260.287
• InChiKey: RCNRDJWVXWYKAB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  18
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  78.9
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  1-methoxycyclopropanol 在 硝酸 、 ferric nitrate 作用下， 生成 Hexan-1,3,6-tricarbonsaeure-trimethylester
  参考文献：
  名称：

  Schaafsma,S.E. et al., Recueil des Travaux Chimiques des Pays-Bas, 1968, vol. 87, p. 1301 - 1312

  摘要：

  DOI：

文献信息

• Facile Tandem Michael Addition-Retro Dieckmann Reaction of Cyclic β-Ketoesters: One-Pot Preparation of Polyfunctionalized Acyclic Derivatives
  作者：Marie-Héléne Filippini、Jean Rodriguez

  DOI：10.1080/00397919508010813

  日期：1995.1

  Abstract A facile base promoted tandem Michael addition-retro Dieckmann reaction leading to polyfunctionalized acyclic derivatives is observed by condensation of β-ketoesters with α,β-unsaturated electrophiles in methanol.

  摘要 通过 β-酮酯与 α,β-不饱和亲电子试剂在甲醇中的缩合，观察到一种简便的碱促进串联迈克尔加成-逆迪克曼反应，导致多官能化无环衍生物。
• One-Pot Base-Promoted Tandem Michael Addition-Intramolecular Aldolization. Stereoselective Synthesis and Reactivity of 2-Hydroxybicyclo[3.2.1]octan-8-ones
  作者：Marie-Helene Filippini、Robert Faure、Jean Rodriguez

  DOI：10.1021/jo00126a044

  日期：1995.10

  alpha-Substituted cyclopentanones 1 react with alpha,beta-unsaturated aldehydes 2 by a facile base-promoted (K2CO3, Cs2CO3, DBU) tandem Michael addition-intramolecular aldol cyclization to give, in synthetically useful yields (30-99%), highly substituted, stereodefined and optically active 2-hydroxybicyclo[3.2.1]octan-8-ones 3-19. A generally separable mixture of isomers, in which the one bearing an equatorial hydroxy group predominates, is obtained with simple aldehydes. In the case of prostereogenic Michael accepters one diastereomer usually prevails from as little as 75% to as much as >97%. This high axial-C-4 stereoselectivity results from a diastereoselective Michael addition and can be easily reversed by simple adaptation of the reaction conditions. The structures of the products rest upon NMR spectroscopy and chemical transformations. The synthetic potential of hydroxybicyclo[3.2.1]octanes is illustrated by transformations of 25-28, especially by their facile conversion to functionalized and stereodefined cycloheptanes 30, 32, 35-42.
• Filippini Marie-Helene, Rodriguez Jean, Synth. Commun, 25 (1995) N 2, S 245-252
  作者：Filippini Marie-Helene, Rodriguez Jean

  DOI：——

  日期：——
• US6085839A
  申请人：——

  公开号：US6085839A

  公开（公告）日：2000-07-11