2-(3,4-dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane | 1594124-68-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-(3,4-dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane
• 英文别名: 5,5-dimethyl-2-(3,4-dimethylphenyl)-1,3,2-dioxaborinane
• CAS: 1594124-68-1
• 化学式: C₁₃H₁₉BO₂
• 分子量: 218.104
• InChiKey: GTXDMHIDFIHEJY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.07
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(3,4-dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane 在 四(三苯基膦)钯 、 potassium carbonate 、 (4S,4′S)-(-)-2,2′-(3-戊烯基)双(4-异丙基噁唑啉) 、 silver(l) oxide 作用下， 以 乙醚 为溶剂， 反应 23.83h， 生成 (S)-4-((3-methoxyphenyl)(phenyl)methyl)-1,2-dimethylbenzene
  参考文献：
  名称：

  Synthesis of Enantiomerically Enriched Triarylmethanes by Enantiospecific Suzuki–Miyaura Cross-Coupling Reactions

  摘要：

  The Suzuki-Miyaura cross-coupling of chiral, enantiomerically enriched dibenzylic boronic esters is described. The reaction proceeds with almost complete retention of stereochemistry, providing access to triaryl-methanes, compounds that have high biological activity and are difficult to prepare in enantiomerically pure form using other methods.

  DOI：

  10.1021/ja412159g
• 作为产物：
  描述：

  3,4-二甲基苯硼酸 、 2,2-二甲基-1,3-丙二醇 在 magnesium sulfate 作用下， 以 乙醚 为溶剂， 反应 20.0h， 以100%的产率得到2-(3,4-dimethylphenyl)-5,5-dimethyl-1,3,2-dioxaborinane
  参考文献：
  名称：

  Synthesis of Enantiomerically Enriched Triarylmethanes by Enantiospecific Suzuki–Miyaura Cross-Coupling Reactions

  摘要：

  The Suzuki-Miyaura cross-coupling of chiral, enantiomerically enriched dibenzylic boronic esters is described. The reaction proceeds with almost complete retention of stereochemistry, providing access to triaryl-methanes, compounds that have high biological activity and are difficult to prepare in enantiomerically pure form using other methods.

  DOI：

  10.1021/ja412159g

文献信息

• FLUORINE-CONTAINING COMPLEX COMPOUND, AND PRODUCTION METHOD FOR FLUORINE-CONTAINING ORGANIC COMPOUND EMPLOYING SAME
  申请人：DAIKIN INDUSTRIES, LTD.

  公开号：US20160214999A1

  公开（公告）日：2016-07-28

  An object of the present invention is to enable the synthesis of various fluorine-containing compounds having an organic group at both terminals of their tetrafluoroethylene structure (—CF 2 —CF 2 —). The present invention provides a fluorine-containing complex compound including a fluorine-containing organic metal compound represented by formula (1a): R 1 —CF 2 —CF 2 -M 1 (1a) wherein M 1 is a metal selected from the group consisting of copper, zinc, nickel, iron, cobalt, and tin; and R 1 represents an organic group, and at least one ligand selected from the group consisting of pyridine ring-containing compounds and phosphines.

  本发明的一个目的是实现具有四氟乙烯结构（—CF2—CF2—）两端具有有机基团的各种含氟化合物的合成。本发明提供了一种含氟复合物化合物，包括由式（1a）表示的含氟有机金属化合物：R1—CF2—CF2-M1（1a）其中M1是选自铜、锌、镍、铁、钴和锡的金属；R1代表有机基团；以及选自含吡啶环化合物和膦的配体中的至少一种。