pentyl propanthioate | 2602-64-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 硫代羧酸及其衍生物
• 英文名称: pentyl propanthioate
• 英文别名: Pentyl-thiopropionat；Propanethioic acid, S-pentyl ester；S-pentyl propanethioate
• CAS: 2602-64-4
• 化学式: C₈H₁₆OS
• 分子量: 160.28
• InChiKey: QWQQABHFUJEFNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  10
• 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：
  42.4
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2930909090

反应信息

• 作为产物：
  描述：

  1-戊硫醇 、 丙酸 在 咪唑 、 碘 、 二苯基氯化膦 作用下， 以 乙腈 为溶剂， 反应 0.67h， 以90%的产率得到pentyl propanthioate
  参考文献：
  名称：

  一种使用氯二苯基膦/ I 2和咪唑试剂系统制备羧酸烷基酯，酚和硫酯的简便方法

  摘要：

  通过在回流乙腈中使用氯二苯基膦，咪唑和分子碘的组合，羧酸与醇，酚和硫醇的缩合反应顺利进行，得到羧酸烷基酯，酚酯和硫代酯。用这种混合试剂系统进行酯化反应，可以以优异的产率得到相应的产物。只需进行碱性水后处理即可简单地从有机相中除去含磷的副产物，而无需进行色谱纯化。

  DOI：

  10.1016/j.tet.2010.10.022

文献信息

• S-Acylation of aliphatic and aromatic thiols with carboxylic acids and their esters over solid acid catalysts in the gas phase at temperatures above 200°C
  作者：Sayoko Nagashima、Hitomi Yamazaki、Kentaro Kudo、Satoshi Kamiguchi、Teiji Chihara

  DOI：10.1016/j.apcata.2013.06.011

  日期：2013.8

  Benzenethiol is reacted with acetic acid in a hydrogen stream over [(Mo6Cl8)Cl4(H2O)2]·6H2O. Catalytic activity of the clusters appears above 200 °C, yielding S-phenyl thioacetate. The selectivity is 98% at 300 °C. Niobium, tantalum, and tungsten halide clusters with the same octahedral metal framework also catalyze the reaction. Benzoic acid and aliphatic carboxylic acids afford the corresponding S-phenyl

  苯硫醇用乙酸在氢气流中在[（反应的Mo 6氯8）氯4（H 2 O）2 ]·6H 2 O.催化簇出现在200℃以上的活性，得到小号-苯基硫代乙酸酯。在300°C下的选择性为98％。具有相同八面体金属骨架的铌，钽和卤化钨簇也催化该反应。苯甲酸和脂族羧酸通过与苯硫醇反应得到相应的S-苯基碳硫盐。脂肪族硫醇也被S-酰化以产生相应的S-烷基硫代碳酸盐。当羧酸酯与苯硫醇在[（Nb 6 Cl 12）Cl 2（H 2 O）4 ]·4H 2 O上于450°C应用于反应时，该酯的空间不受阻碍的部分被并入产物中：S选择性地获得-苯基硫代乙酸酯或甲基苯基硫。通过热活化在簇状配合物上形成的布朗斯台德酸位点是催化剂的活性位点。因此，在200°C以上稳定的固体酸（例如二氧化硅-氧化铝，沸石和杂多酸）也会催化这些反应。
• Easily Prepared Azopyridines As Potent and Recyclable Reagents for Facile Esterification Reactions. An Efficient Modified Mitsunobu Reaction
  作者：Nasser Iranpoor、Habib Firouzabadi、Dariush Khalili、Somayeh Motevalli

  DOI：10.1021/jo8000782

  日期：2008.7.1

  class of electron-deficient reagents for Mitsunobu esterification reactions. Among these compounds, 4,4′-azopyridine was found to be the most suitable one for esterification and thioesterification reactions. This new reagent promises to provide general and complementary solutions for separation problems in Mitsunobu reactions without restricting the reaction scope and facilitates the isolation of its

  研究了2,2'-，3,3'-和4,4'-偶氮吡啶（azpy）及其烷基吡啶鎓离子液体，作为用于Mitsunobu酯化反应的新型缺电子试剂。在这些化合物中，发现4,4'-偶氮吡啶是最适合酯化和硫酯化反应的化合物。这种新试剂有望为Mitsunobu反应中的分离问题提供通用和补充的解决方案，而不会限制反应范围，并有助于分离其肼副产物。吡啶肼副产物可通过氧化反应简单地再循环至其偶氮吡啶。
• POLYNUCLEOTIDES HAVING BIOREVERSIBLE GROUPS
  申请人：The Regents of the University of California

  公开号：US20150238516A1

  公开（公告）日：2015-08-27

  The disclosure provides methods and compositions for delivering polynucleotides into cells. The disclosure provides transiently protected polynucleotides comprising an anionic charge-neutralizing moiety/group, which may also confer additional functionality. These compounds can enter the cytosol of cells by endocytic or macropinocytic mechanisms. The transient protecting group is bioreversible, i.e., once inside a cell, it is designed to be removed by enzymatic activity or by passive intracellular methods (e.g., changes in pH or reductive environment).

  该披露提供了将多核苷酸传递到细胞中的方法和组合物。该披露提供了暂时保护的多核苷酸，其中包含一个阴离子电荷中和的基团，这可能还赋予了额外的功能。这些化合物可以通过内吞或巨胞吞噬机制进入细胞的细胞质。暂时的保护基团是可生物逆转的，即一旦进入细胞内，它被设计为能够通过酶活性或被动的细胞内方法（例如，pH值的变化或还原环境）来去除。
• [EN] POLYNUCLEOTIDES HAVING BIOREVERSIBLE GROUPS<br/>[FR] POLYNUCLÉOTIDES POSSÉDANT DES GROUPES BIORÉVERSIBLES
  申请人：UNIV CALIFORNIA

  公开号：WO2014031575A1

  公开（公告）日：2014-02-27

  The disclosure provides methods and compositions for delivering polynucleotides into cells. The disclosure provides transiently protected polynucleotides comprising an anionic charge- neutralizing moiety/group, which may also confer additional functionality. These compounds can enter the cytosol of cells by endocytic or macropinocytic mechanisms. The transient protecting group is bioreversible, i.e., once inside a cell, it is designed to be removed by enzymatic activity or by passive intracellular methods (e.g., changes in pH or reductive environment).
• A simple and convenient method for preparation of carboxylic acid alkyl esters, phenolic and thioesters using chlorodiphenylphosphine/I2 and imidazole reagent system
  作者：Najmeh Nowrouzi、Abdol Mohammad Mehranpour、Javad Ameri Rad

  DOI：10.1016/j.tet.2010.10.022

  日期：2010.12

  Condensation of carboxylic acids with alcohols, phenols and thiols proceeded smoothly to afford carboxylic acid alkyl esters, phenolic esters and thioesters by using the combination of chlorodiphenylphosphine, imidazole and molecular iodine in refluxing acetonitrile. Esterification with this mixed reagent system gave the corresponding products in excellent yields. The phosphorus-containing byproduct

  通过在回流乙腈中使用氯二苯基膦，咪唑和分子碘的组合，羧酸与醇，酚和硫醇的缩合反应顺利进行，得到羧酸烷基酯，酚酯和硫代酯。用这种混合试剂系统进行酯化反应，可以以优异的产率得到相应的产物。只需进行碱性水后处理即可简单地从有机相中除去含磷的副产物，而无需进行色谱纯化。