2-(4-甲基)-苯基-丁腈 | 104316-19-0

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 中文名称: 2-(4-甲基)-苯基-丁腈
• 英文名称: 2-(4-methyl)-phenyl-butyronitrile
• 英文别名: 2-(4-methylphenyl)butanenitrile；2-p-tolylbutanenitrile；2-p-tolyl-butyronitrile；rac-2-p-tolyl-butyronitrile
• CAS: 104316-19-0
• 化学式: C₁₁H₁₃N
• 分子量: 159.231
• InChiKey: QDKMTOXKMLVUOS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  23.8
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2-(4-甲基)-苯基-丁腈 在 氢氧化钾 作用下， 生成 alpha-乙基-4-甲基-苯乙酸
  参考文献：
  名称：

  Rupe; Wiederkehr, Helvetica Chimica Acta, 1924, vol. 7, p. 664

  摘要：

  DOI：
• 作为产物：
  描述：

  对甲基苯乙腈 在 乙醚 、 sodium amide 作用下， 生成 2-(4-甲基)-苯基-丁腈
  参考文献：
  名称：

  Rupe; Wiederkehr, Helvetica Chimica Acta, 1924, vol. 7, p. 664

  摘要：

  DOI：

文献信息

• COPPER(I) IODIDE-MEDIATED ARYLATION OF DIALKYL CYANOMETHANEPHOSPHONATES. A NOVEL ROUTE TO α-ARYLATED ALKANENITRILES
  作者：Hitomi Suzuki、Kazue Watanabe、QUI Yi

  DOI：10.1246/cl.1985.1779

  日期：1985.11.5

  Copper(I)-catalyzed arylation of dialkyl cyanomethanephosphonate anions in hot hexamethylphosphoric triamide affords α-arylalkanenitriles in moderate to good yields.

  在高温六甲基磷酰三胺中，通过铜(I)催化芳基化反应，二烷基氰甲基膦酸酯阴离子能够以中等至良好的产率生成α-芳基烷基腈。
• Environmentally Friendly One-Pot Synthesis of α-Alkylated Nitriles Using Hydrotalcite-Supported Metal Species as Multifunctional Solid Catalysts
  作者：Ken Motokura、Noriaki Fujita、Kohsuke Mori、Tomoo Mizugaki、Kohki Ebitani、Koichiro Jitsukawa、Kiyotomi Kaneda

  DOI：10.1002/chem.200600317

  日期：2006.11.6

  diameter of about 70 A is observed on the Pd(nano)/HT surface by transmission electron microscopy analysis. These hydrotalcite-supported metal catalysts can effectively promote alpha-alkylation reactions of various nitriles with primary alcohols or carbonyl compounds through tandem reactions consisting of metal-catalyzed oxidation and reduction, and an aldol reaction promoted by the base sites of the

  通过处理碱性层状双氢氧化物，水滑石（HT，Mg（6）Al（2）（OH）（ 16）CO（3））与RuCl（3）n H（2）O和K（2）[PdCl（4）]水溶液分别使用表面浸渍法。通过X射线衍射，能量色散X射线，电子顺磁共振和X射线吸收精细结构光谱分析，证明了Ru（IV）单体已接枝到HT的表面。同时，在减少表面分离的Pd（II）种类之后，通过透射电子显微镜分析在Pd（纳米）/ HT表面上观察到平均直径为约70A的高度分散的Pd纳米团簇。这些水滑石负载的金属催化剂可通过由金属催化的氧化和还原组成的串联反应，以及由HT的碱位促进的羟醛反应，有效地促进各种腈与伯醇或羰基化合物的α-烷基化反应。在这些催化的α-烷基化反应中，均质的碱是不必要的，唯一的副产物是水。另外，这些催化剂体系适用于戊二腈衍生物的一锅法合成。
• Method for the treatment of CNS disorders with substituted 2-imidazoles or imidazole derivatives
  申请人：Galley Guido

  公开号：US20070197621A1

  公开（公告）日：2007-08-23

  The present invention relates a method for treating depression, anxiety disorders, bipolar disorder, attention deficit hyperactivity disorder, stress-related disorders, psychotic disorders such as schizophrenia, neurological diseases such as Parkinson's disease, neurodegenerative disorders such as Alzheimer's disease, epilepsy, migraine, hypertension, substance abuse and metabolic disorders such as eating disorders, diabetes, diabetic complications, obesity, dyslipidemia, disorders of energy consumption and assimilation, disorders and malfunction of body temperature homeostasis, disorders of sleep and circadian rhythm, and cardiovascular disorders which comprises administering to an individual a therapeutically effective amount of a compound of formula I wherein R, R 1 , R 2 , A and n are as defined in the specification and to their pharmaceutically active salts. The invention also relates to novel compounds of formula I, pharmaceutical compositions containing them, and methods for their preparation.

  本发明涉及一种治疗抑郁症、焦虑症、双相情感障碍、注意力缺陷多动障碍、压力相关障碍、精神分裂症等精神障碍、帕金森病等神经系统疾病、阿尔茨海默病等神经退行性疾病、癫痫、偏头痛、高血压、物质滥用、进食障碍、糖尿病、糖尿病并发症、肥胖症、血脂异常、能量消耗和吸收障碍、体温稳态障碍、睡眠和昼夜节律障碍以及心血管疾病的方法，包括向个体施用化合物I的治疗有效量，其中R、R1、R2、A和n如规范中所定义，以及其药用活性盐。该发明还涉及化合物I的新颖化合物、含有它们的药物组合物以及它们的制备方法。
• Novel α-arylnitriles synthesis via Ni-catalyzed cross-coupling of α-bromonitriles with arylboronic acids under mild conditions
  作者：Yingying Yang、Shan Tang、Chao Liu、Huimin Zhang、Zhexun Sun、Aiwen Lei

  DOI：10.1039/c1ob05326d

  日期：——

  An applicable and easy-handling Ni-catalyst can be used to promote direct arylation of α-bromonitriles with various arylboronic acids to construct α-arylnitriles under mild conditions. The methodology tolerates β-hydrogens and functional groups in the substrates.

  一种适用且易于操作的镍催化剂可用于促进α-溴腈与各种芳基硼酸的直接芳基化反应，在温和条件下构建α-芳基腈。这一方法对底物中的β-氢和官能团具有良好的耐受性。
• [EN] PSEUDO TRÖGER'S BASE AMINES AND MICROPOROUS POLYMERS DERIVED FROM PSEUDO TRÖGER'S BASE AMINES<br/>[FR] AMINES DE PSEUDO BASE DE TRÖGER ET POLYMÈRES MICROPOREUX DÉRIVÉS D'AMINES DE PSEUDO BASE DE TRÖGER
  申请人：UNIV KING ABDULLAH SCI & TECH

  公开号：WO2019012349A1

  公开（公告）日：2019-01-17

  Embodiments of the present disclosure describe carbocyclic pseudo Tröger's base (CTB) amines. Embodiments of the present disclosure further describe microporous polymers derived from pseudo CTB amines, including, but not limited to, polyimides, CTB ladder polymers, and network porous polymers. Other embodiments describe a method of separating chemical species in a fluid composition comprising contacting a microporous polymer membrane with a fluid composition including at least two chemical species, wherein the microporous polymer membrane includes one or more of a ladder polymer of intrinsic microporosity, a microporous polyimide, and a microporous network polymer; and capturing at least one of the chemical species from the fluid composition.

  本公开的实施例描述了碳环假Tröger碱（CTB）胺。本公开的实施例进一步描述了由假CTB胺衍生的微孔聚合物，包括但不限于聚酰亚胺、CTB梯形聚合物和网络多孔聚合物。其他实施例描述了一种分离流体组分中化学物种的方法，包括将微孔聚合物膜与包括至少两种化学物种的流体组分接触，其中微孔聚合物膜包括固有微孔性的梯形聚合物、微孔聚酰亚胺和微孔网络聚合物中的一种或多种；并从流体组分中捕获至少一种化学物种。