2-[4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)but-3-enyloxy]tetrahydropyran | 313342-78-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 氧烷类
• 英文名称: 2-[4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)but-3-enyloxy]tetrahydropyran
• 英文别名: 2-{[(3E)-4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-enyl]oxy}tetrahydro-2H-pyran；(E)-4,4,5,5-Tetramethyl-2-(4-((tetrahydro-2H-pyran-2-yl)oxy)but-1-en-1-yl)-1,3,2-dioxaborolane；4,4,5,5-tetramethyl-2-[(E)-4-(oxan-2-yloxy)but-1-enyl]-1,3,2-dioxaborolane
• CAS: 313342-78-8
• 化学式: C₁₅H₂₇BO₄
• 分子量: 282.188
• InChiKey: RCXKQCXECXMTBA-UXBLZVDNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.11
• 重原子数：
  20
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.87
• 拓扑面积：
  36.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-[4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)but-3-enyloxy]tetrahydropyran 在 吡啶 、 双氧水 、 sodium carbonate 作用下， 以 四氢呋喃 为溶剂， 反应 56.0h， 生成 Acetic acid (4S,5R)-3-(4-cyano-phenyl)-5-[2-(tetrahydro-pyran-2-yloxy)-ethyl]-4,5-dihydro-isoxazol-4-yl ester
  参考文献：
  名称：

  血小板糖蛋白IIb / IIIa受体拮抗剂roxifiban的异恶唑啉环羟基化代谢物的顺式和反式异构体的合成。

  摘要：

  DOI：

  10.1021/jo000755o
• 作为产物：
  描述：

  2-(3-丁炔氧基)四水-2H-吡喃 、 频那醇硼烷 在 Schwartz's reagent 三乙胺 作用下， 反应 16.0h， 以90%的产率得到2-[4-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)but-3-enyloxy]tetrahydropyran
  参考文献：
  名称：

  Zr-Mediated hydroboration: stereoselective synthesis of vinyl boronic esters

  摘要：

  An improved process for the preparation of (E)-vinylboronic esters via a Zr-mediated hydroboration of alkynes, especially oxygen-containing alkynes, is described. (c) 2005 Published by Elsevier Ltd.

  DOI：

  10.1016/j.tetlet.2005.10.031

文献信息

• PREPARATION OF 7-ALKENYL-3 QUINOLINECARBONITRILES VIA A PALLADIUM MEDIATED COUPLING REACTION
  申请人：Wang Yanong Daniel

  公开号：US20090099356A1

  公开（公告）日：2009-04-16

  The present invention is directed to a process for preparing compounds of formula (I): wherein A, R 1 -R 3 , X, s, t, u, m and Z are defined herein, comprising the step of reacting a reagent of formula (II): in the presence of Pd(O) metal with a compound of formula (III): or salts thereof. Another aspect of this invention is a method of preparing compounds of formula (VI).

  本发明涉及一种制备式（I）化合物的过程：其中A、R1-R3、X、s、t、u、m和Z在此定义，包括在Pd（O）金属存在下将式（II）试剂与式（III）化合物或其盐反应的步骤。本发明的另一个方面是一种制备式（VI）化合物的方法。
• MODULATION OF CHEMOSENSORY RECEPTORS AND LIGANDS ASSOCIATED THEREWITH
  申请人：Tachdjian Catherine

  公开号：US20110224155A1

  公开（公告）日：2011-09-15

  The present invention includes methods for identifying modifiers of chemosensory receptors and their ligands, e.g., by determining whether a test entity is suitable to interact with one or more interacting sites within the Venus flytrap domains of the chemosensory receptors, and modifiers capable of modulating chemosensory receptors and their ligands. The present invention also includes modifiers of chemosensory receptors and their ligands having Formula (I), its subgenus, and specific compounds. Furthermore, the present invention includes ingestible compositions comprising the modifiers of chemosensory receptors and their ligands and methods of using the modifiers of chemosensory receptors and their ligands to enhance the sweet taste of an ingestible composition or treat a condition associated with a chemosensory receptor. In addition, the present invention include processes for preparing the modifiers of chemosensory receptors and their ligands.

  本发明包括识别化学感受受体及其配体的修饰剂的方法，例如通过确定测试实体是否适合与化学感受受体的捕蝇草结构域中的一个或多个相互作用位点发生相互作用，并且能够调节化学感受受体及其配体的修饰剂。本发明还包括化学感受受体及其配体的修饰剂，其具有式（I）、其亚属和具体化合物。此外，本发明还包括包含化学感受受体及其配体的修饰剂的可食用组合物以及使用化学感受受体及其配体的修饰剂增强可食用组合物的甜味或治疗与化学感受受体相关的疾病的方法。此外，本发明还包括制备化学感受受体及其配体的修饰剂的过程。
• Modulation of chemosensory receptors and ligands associated therewith
  申请人：Tachdjian Catherine

  公开号：US08633186B2

  公开（公告）日：2014-01-21

  The present invention includes methods for identifying modifiers of chemosensory receptors and their ligands, e.g., by determining whether a test entity is suitable to interact with one or more interacting sites within the Venus flytrap domains of the chemosensory receptors, and modifiers capable of modulating chemosensory receptors and their ligands. The present invention also includes modifiers of chemosensory receptors and their ligands having Formula (I), its subgenus, and specific compounds. Furthermore, the present invention includes ingestible compositions comprising the modifiers of chemosensory receptors and their ligands and methods of using the modifiers of chemosensory receptors and their ligands to enhance the sweet taste of an ingestible composition or treat a condition associated with a chemosensory receptor. In addition, the present invention include processes for preparing the modifiers of chemosensory receptors and their ligands.

  本发明涉及识别化学感受器及其配体的修饰剂的方法，例如，通过确定测试实体是否适合与化学感受器的食虫植物结构域内的一个或多个相互作用位点相互作用来确定。本发明还包括能够调节化学感受器及其配体的修饰剂。本发明还包括具有公式（I）、其亚属和特定化合物的化学感受器及其配体的修饰剂。此外，本发明包括包含化学感受器及其配体的修饰剂的可食用组合物，并使用化学感受器及其配体的修饰剂来增强可食用组合物的甜味或治疗与化学感受器相关的疾病的方法。此外，本发明还包括制备化学感受器及其配体的修饰剂的方法。
• Pd-Catalyzed Cross-Coupling of Potassium Alkenyltrifluoroborates with 2-Chloroacetates and 2-Chloroacetamides
  作者：Gary A. Molander、Thiago Barcellos、Kaitlin M. Traister

  DOI：10.1021/ol401377q

  日期：2013.7.5

  A protocol for the stereocontrolled synthesis of (E)- and (Z)-beta,gamma-unsaturated esters and amides is reported. 2-Chloroacetates as well as secondary and tertiary 2-chloroacetamides were successfully employed as electrophiles in the Suzuki-Miyaura cross-coupling reaction with potassium (E)- and (Z)-alkenyltrifluoroborates, affording the corresponding products in high yield.