1-butanol,ethyl acetate | 58160-62-6

• 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: 1-butanol,ethyl acetate
• 英文别名: n-butanol,ethyl acetate；butanol,ethyl acetate；3-Hydroxyhexyl acetate
• CAS: 58160-62-6
• 化学式: C₈H₁₆O₃
• 分子量: 160.213
• InChiKey: XCGLNYGKTKBEMF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  11
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-butanol,ethyl acetate 在 potassium carbonate 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 acetic acid 3-(2-benzoyl-4-ethyl-phenoxy)-hexyl ester
  参考文献：
  名称：

  Design and Synthesis of Dual Peroxisome Proliferator-Activated Receptors γ and δ Agonists as Novel Euglycemic Agents with a Reduced Weight Gain Profile

  摘要：

  The design and synthesis of the dual peroxisome proliferator-activated receptor ( PPAR) gamma/delta agonist (R)-3-{4-[3-(4-chloro-2-phenoxyphenoxy)-butoxy]-2-ethyl-phenyl}-propionic acid (20) for the treatment of type 2 diabetes and associated dyslipidemia is described. The compound possesses a potent dual hPPAR gamma/delta agonist profile (IC50 = 19 nM/4 nM; EC50 = 102 nM/6 nM for hPPAR gamma and hPPAR delta, respectively). In preclinical models, the compound improves insulin sensitivity and reverses diabetic hyperglycemia with less weight gain at a given level of glucose control relative to rosiglitazone.

  DOI：

  10.1021/jm060617c
• 作为产物：
  描述：

  叶醇 在 potassium fluoride 、 potassium hydrogencarbonate 、 zinc(II) chloride 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 反应 3.0h， 生成 1-butanol,ethyl acetate
  参考文献：
  名称：

  通过分子内氢化硅烷从烯丙醇和高烯丙醇制备区域选择性单保护 1,3-二醇的新途径

  摘要：

  烯丙醇和高烯丙醇转化为 1,3-二醇衍生物，其中通过一系列分子内氢化硅烷化、保护和碳硅键氧化裂解，仅对最初存在的羟基进行区域选择性保护。还描述了立体化学方面。

  DOI：

  10.1246/cl.1987.171

文献信息

• Tetrapeptidesemicarbazide derivatives and their production and use
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP0031567A2

  公开（公告）日：1981-07-08

  Novel tetrapeptidesemicarbazide derivatives, inclusive of a pharmacologically acceptable salt thereof, which has the general formula (I): wherein R1 is hydrogen or lower alkyl; R2 is hydrogen or a D-α-amino acid side chain; R3 is hydrogen or lower alkyl; X is oxygen or sulfur, are useful as analgesics.

  具有通式(I)的新型四肽emicarbazide 衍生物，包括其药理学上可接受的盐： 其中 R1 为氢或低级烷基；R2 为氢或 D-α-氨基酸侧链；R3 为氢或低级烷基；X 为氧或硫，可用作镇痛剂。
• Process for producing arginyl-p-nitroanilide
  申请人：NITTO BOSEKI CO., LTD.

  公开号：EP0137742A1

  公开（公告）日：1985-04-17

  An Nα-protected-NG-protected-arginyl-p-nitroanilide with high purity can be produced in high yield by reacting an Nα-protected-NG-protected-arginine with p-nitroaniline in pyridine in the presence of a condensing agent.

  在有缩合剂存在的情况下，将 Nα-保护-NG-保护-精氨酸与对硝基苯胺在吡啶中进行反应，可以高产率地生产出高纯度的 Nα-保护-NG-保护-精氨酰-对硝基苯胺。
• Compounds and methods for promoting smoking cessation
  申请人：Research Triangle Institute

  公开号：EP2494975A1

  公开（公告）日：2012-09-05

  Compounds and methods for promoting smoking cessation. The compounds may be used to treat a variety of other conditions and disease states.

  促进戒烟的化合物和方法。这些化合物可用于治疗各种其他病症和疾病状态。
• Regioselective opening of epoxy alcohols: mild chemo- and stereoselective preparation of iodohydrins and 1,2-diols
  作者：Carlo Bonini、Giuliana Righi、Giovanni Sotgiu

  DOI：10.1021/jo00021a045

  日期：1991.10

  Several 2,3-epoxy alcohols have been opened, at -60-degrees-C, with MgI2, leading to the corresponding 3-iodo 1,2-diols with a high level of regio- and chemoselectivity. The iodohydrins can be reduced "in situ", by means of nBu3SnH, to the corresponding 1,2-diols. The chemo-, regio-, and stereocontrol of the reaction makes the method of wide use. Furthermore, epoxy alcohol derivatives (acetyl, benzyl, or TBMS) still maintain a strong preference for C-3 attack of the nucleophile. The experimental data strongly suggest that a metal (Mg) centered chelate is formed throughout the reaction, which gives rise to the regioselective delivery of the iodide ion.
• TAMAO KOHEI; YAMAUCHI TAKAYOSHI; ITO YOSHIHIKO, CHEM. LETT.,(1987) N 1, 171-174
  作者：TAMAO KOHEI、 YAMAUCHI TAKAYOSHI、 ITO YOSHIHIKO

  DOI：——

  日期：——