n-Hexyloxyessigsaeure-methylester | 70038-38-9

• 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: n-Hexyloxyessigsaeure-methylester
• 英文别名: Methyl 2-hexoxyacetate
• CAS: 70038-38-9
• 化学式: C₉H₁₈O₃
• 分子量: 174.24
• InChiKey: KKQCNZLPPHGLBD-UHFFFAOYSA-N

物化性质

• 沸点：
  230.2±13.0 °C(Predicted)
• 密度：
  0.932±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  12
• 可旋转键数：
  8
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  甲酸甲酯 、 n-Hexyloxyessigsaeure-methylester 、 万古霉素 在 potassium tert-butylate 作用下， 以 乙醚 、 N,N-二甲基甲酰胺 为溶剂， 反应 17.0h， 生成
  参考文献：
  名称：

  Design and synthesis of new vancomycin derivatives

  摘要：

  A set of vancomycin derivatives with lipid chain attached via a glyceric acid linker was designed and synthesized. A concise synthesis towards these derivatives was developed and the IC(50)s of these new lipoglycopeptides were tested. Some of them showed very potent activity against both vancomycin sensitive and resistant strains. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.03.093
• 作为产物：
  描述：

  正己醇 在 氯化亚砜 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 生成 n-Hexyloxyessigsaeure-methylester
  参考文献：
  名称：

  Design and synthesis of new vancomycin derivatives

  摘要：

  A set of vancomycin derivatives with lipid chain attached via a glyceric acid linker was designed and synthesized. A concise synthesis towards these derivatives was developed and the IC(50)s of these new lipoglycopeptides were tested. Some of them showed very potent activity against both vancomycin sensitive and resistant strains. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2014.03.093

文献信息

• Transition-metal-catalyzed reaction of diazocompounds, efficient synthesis of functionalized ethers by carbene insertion into the hydroxylic bond of alcohols
  作者：A.F. Noels、A. Demonceau、N. Petiniot、A.J. Hubert、Ph. Teyssié

  DOI：10.1016/0040-4020(82)80031-8

  日期：——

  An Efficient catalytic synthesis of unsaturated ethers by carbene insertion (with diazoesters as carbene precursors) into the OH bond of unsaturated alcohols is reported. The regioselectivity for the OH insertion is high. However, depending on the catalyst counter-ions and the diazoester alkoxy group, addition to the unsaturated centre can be promoted to some extent, yielding then cyclopropyl and cyclopropenyl

  据报道，通过将卡宾（以重氮酸酯作为卡宾的前体）插入不饱和醇的OH键，可以有效地催化合成不饱和醚。OH插入的区域选择性高。然而，取决于催化剂的抗衡离子和重氮酯烷氧基，可以在一定程度上促进向不饱和中心的加成，然后得到环丙基和环丙烯基甲醇。讨论了反应的机理。
• 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES
  申请人：Sankyo Company, Limited

  公开号：EP1304325A1

  公开（公告）日：2003-04-23

  Provided is a 5-(m-cyanobenzylamino)pyrazole derivative represented by the following formula:    wherein: R1 represents a C1-6 alkyl group, a C3-7 cycloalkyl group or a phenyl group; R2 represents a hydrogen atom or a C1-6 alkyl group; R3 represents a C1-6 alkyl, etc., R4 represents a hydrogen atom, a halogen atom, a C1-6 alkyl group, etc., Y represents a C1-6 alkyl group, etc.; and n is an integer of 0 to 4; or a salt thereof.

  本发明提供了由下式表示的 5-(间氰基苄基氨基)吡唑衍生物： 其中 R1代表C1-6烷基、C3-7环烷基或苯基； R2代表氢原子或C1-6烷基 R3 代表 C1-6 烷基等、 R4 代表氢原子、卤素原子、C1-6 烷基等、 Y 代表 C1-6 烷基等；以及 n 是 0 至 4 的整数； 或其盐。
• Antifungal Properties of n-Alkoxyacetic Acids and Their Methyl Esters
  作者：Herman Gershon、Larry Shanks、Alan Deangelis

  DOI：10.1002/jps.2600680125

  日期：1979.1
• NOELS, A. F.;DEMONCEAU, A.;PETINIOT, N.;HUBERT, A. J.;TEYSSIE, PH., TETRAHEDRON, 1982, 38, N 17, 2733-2739
  作者：NOELS, A. F.、DEMONCEAU, A.、PETINIOT, N.、HUBERT, A. J.、TEYSSIE, PH.

  DOI：——

  日期：——