(2,6-di(o-anisol)phenyl)lithium | 1186428-58-9

• 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: (2,6-di(o-anisol)phenyl)lithium
• 英文别名: 2,6-bis(o-anisyl)phenyllithium；2,6-di(o-anisol)phenyl lithium；lithium(2,6-di-o-anisylphenyl)；2,6-di-o-anisophenyllithium；2,6-di(o-anisole)phenyl lithium；(2,6-di(o-anisol)phenyl)Li
• CAS: 1186428-58-9
• 化学式: C₂₀H₁₇LiO₂
• 分子量: 296.295
• InChiKey: DDBMJARKADARDP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.83
• 重原子数：
  23.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  18.46
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  氯化镱(III) 、 (2,6-di(o-anisol)phenyl)lithium 、 POTASSIUM PENTAMETHYLCYCLOPENTADIENIDE 以 not given 为溶剂， 生成 (2,6-bis(o-anisyl)phenyl)Yb(Cp*)Cl
  参考文献：
  名称：

  A Partially Demethylated Donor-Functionalized Terphenyl Lanthanide Compound

  摘要：

  The synthesis and structural characterization of an unsolvated lanthanide half-sandwich compound of composition [DanipOSmCp*](2) (1) is reported featuring a novel dianionic partially demethylated donor-functionalized terphenyl ligand [DanipO = 2-(o-anisyl)-6-(o-2-phenoxide)phenyl].

  DOI：

  10.1021/om070010+

文献信息

• Flexible Coordination Mode of a Donor-Functionalized Terphenyl Ligand in Monomeric Cp-Based Lanthanocenes
  作者：Gerd W. Rabe、Florian A. Riederer、Mei Zhang-Presse、Arnold L. Rheingold

  DOI：10.1021/om900465c

  日期：2009.9.14

  The synthesis and structural characterization of monomeric Cp-based metallocene compounds of the rare-earth elements samarium, yttrium, and ytterbium of general composition Cp2LnDanip (Danip = 2,6-di-o-anisylphenyl) is reported, featuring a donor-functionalized terphenyl moiety as a coligand. Depending on the size of the rare-earth element employed, different coordination modes of the terphenyl moiety

  据报道，一般组成为Cp 2 LnDanip（Danip = 2,6- di - o - anisylphenyl）的稀土元素sa ，钇和的单体Cp基金属茂化合物的合成和结构表征。功能化的三联苯基部分作为大肠菌。根据所使用的稀土元素的大小，观察到三联苯基部分的不同配位模式。在sa阳离子相对较大的情况下，来自三联苯配体的两个甲氧基均与金属阳离子对称配位。但是，当使用较小的阳离子（钇和）时，会发现三苯基配体的柔性，不对称配位模式。
• Donor-Functionalized Lanthanide Terphenyl Complexes:  Synthesis and Structural Characterization of 2,6-Di(<i>o</i>-anisol)phenyl Compounds of Ytterbium, Yttrium, and Samarium
  作者：Gerd W. Rabe、Mei Zhang-Presse、Florian A. Riederer、Glenn P. A. Yap

  DOI：10.1021/ic0300161

  日期：2003.6.1

  6-diisopropylphenyl) produces DanipYb[O(2,6-diisopropylphenyl)](2) (4). Our attempts to also prepare the yttrium analogue of complex 4 yielded single-crystalline material of the tetrahydrofuran adduct DanipY(THF)[O(2,6-diisopropylphenyl)](2) (5). The molecular structures of the complexes 1-4 feature five-coordinate metal atoms and coordination polyhedra which can be described as distorted square-pyramidal

  报道了a，钇和a的许多基于2，6-二（邻茴香醚）苯基（[双键] Danip-）的双（酰胺）和双（醇盐）化合物的合成和分子结构。另外，报道了类似的抗磁性钇化合物的NMR光谱数据。室温下，等摩尔量的DanipLi和YbCl（3）在四氢呋喃中进行盐易位反应，然后添加2当量的KN（SiMe（3））（2）或KN（SiHMe（2））（2）生成DanipYb [N （SiMe（3））（2）]（2）（1）和DanipYb [N（SiHMe（2））（2）]（2）（2）。使用SmCl（3）和KN（SiHMe（2））（2）的类似反应产生DanipSm [N（SiHMe（2））（2）]（2）（3）。DanipLi和YbCl（3）在室温下于四氢呋喃中反应，然后添加2当量的KO（2,6-二异丙基苯基）产生DanipYb [O（2,6-二异丙基苯基）]（2）（4）。我们还尝试制备配合物4的钇类似物，得到四氢呋喃加合物DanipY（THF）[O（2
• Terphenyl Cyclooctatetraenyl Compounds of Samarium
  作者：Gerd W. Rabe、Mei Zhang-Presse、Florian A. Riederer、James A. Golen、Christopher D. Incarvito、Arnold L. Rheingold

  DOI：10.1021/ic0301775

  日期：2003.11.1

  Danip-based compound 4 the order of addition of reagents can be reversed producing the same compound, however, in considerably lower yield. Compound 2 can also be prepared by reaction of 1 with 1 equiv of K(2)COT in tetrahydrofuran. The molecular structure of the bis(terphenyl) compound 1 exhibits a formally four-coordinate metal atom. The molecular structures of the terphenyl COT compounds 2-4 feature

  报道了镧系元素sa的许多基于三联苯的化合物的合成和分子结构。室温下，2当量的DppLi（Dpp = 2,6-二苯基苯基）与1当量的SmCl（3）在四氢呋喃中反应生成（Dpp）（2）SmCl（micro-Cl）Li（THF）（3）（1 ）。在室温下在四氢呋喃中与1当量SmCl（3）进行一锅当量的K（2）COT（COT（2）（-）=环辛二烯基二价阴离子）的一锅反应，然后添加1当量的三苯基锂盐DppLi，DmpLi （Dmp = 2,6-dimesitylphenyl）或DanipLi（Danip = 2,6-di（o-anisol）phenyl）产生DppSmCOT（micro-Cl）Li（THF）（3）（2），DmpSm（THF）COT （3）和DanipSm（THF）COT（4）。在基于Danip的化合物4的情况下，可以颠倒试剂的添加顺序以产生相同的化合物，但是产率相当低。化合物2也可以通
• Synthesis and X-ray Crystal Structure Determination of First Examples of Donor-Functionalized Terphenyl Lanthanide Complexes
  作者：Gerd W. Rabe、Christian D. Bérubé、Glenn P. A. Yap

  DOI：10.1021/ic010194z

  日期：2001.8.27

  donor-functionalized terphenyl complexes of the elements ytterbium, yttrium, and samarium, respectively. The molecular structures of 1-3 feature a "constraint geometry" type arrangement of the Danip ligand at the lanthanide atom. The complexes reported are dimeric and composed of lithium chloride bridged DanipLnCl(2) moieties (Ln = Yb, Y, Sm), stabilized through additional coordination of two methoxy functions

  [DanipYb（mu2-Cl）2（mu3-Cl）Li（THF）] 2（1）和[DanipLn（mu2-Cl）]的三价，钇和sa的新型供体官能化三联苯衍生物的分子结构据报道有2（mu2-Cl）Li（THF）2] 2（Ln ＝ Y，2； Ln ＝ Sm，3）[Danip ＝ 2，6-二（邻-茴香醚）苯基]。在室温下，等摩尔量的DanipLi和LnCl3（Ln = Yb，Y，Sm）在四氢呋喃中的反应以60％的产率得到络合物。1-2甲苯在单斜空间群Ponebar中结晶。203 K下1-2甲苯的晶体数据：a = 9.7281（9）A; b = 12.7989（12）A；c = 13.4870（12）A; alpha = 91.553（2）度；beta = 103.957（2）度；伽玛= 109.916（2）度; V = 1521.2（2）A（3）; Z'= 1；D（计算的）＝ 1.615g cm（-3）；R1
• Synthesis and structural characterization of terphenyl based mono(indenide) compounds of the rare-earth elements
  作者：Gerd W. Rabe、Florian A. Riederer、Mei Zhang-Preße、Arnold L. Rheingold

  DOI：10.1016/j.ica.2009.10.018

  日期：2010.1

  The synthesis and X-ray crystal structure determination of the mono(indenide) rare-earth compounds [(DanipO)(Ind)Ln](2) (Ln = Sm: 1; Ln = Yb: 2) are reported (DanipO = 2-(o-anisyl)-6-(o-2-phenoxide)phenyl, Ind = indenide). Reaction of DanipLi (Danip = 2,6-di-o-anisolphenyl) with the corresponding lanthanide trichloride in tetrahydrofuran followed by addition of two equiv of KInd in tetrahydrofuran at -25 degrees C yields compounds 1 and 2 in approximately 10-20% yield. The molecular structures of 1 and 2 show an unsolvated dimeric half-sandwich compound and a formally dianionic partially demethylated mixed arylether/aryloxide terphenyl ligand (= DanipO). (C) 2009 Elsevier B. V. All rights reserved.