4-溴-2,3-二甲基乙酰苯胺 | 22369-96-6

• 物质功能分类: 有机原料 - 氨基化合物 - 酰胺类化合物
• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 4-溴-2,3-二甲基乙酰苯胺
• 英文名称: 4-bromo-2,3-dimethylacetanilide
• 英文别名: acetic acid-(4-bromo-2,3-dimethyl-anilide)；Essigsaeure-(4-brom-2,3-dimethyl-anilid)；n-(4-Bromo-2,3-dimethylphenyl)acetamide
• CAS: 22369-96-6
• 化学式: C₁₀H₁₂BrNO
• 分子量: 242.115
• InChiKey: DRLNKKJJMCEQAD-UHFFFAOYSA-N

物化性质

• 熔点：
  158-160 °C(Solv: water (7732-18-5); ethanol (64-17-5))
• 沸点：
  346.1±30.0 °C(Predicted)
• 密度：
  1.413±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  29.1
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2924299090

反应信息

• 作为反应物：
  描述：

  4-溴-2,3-二甲基乙酰苯胺 在 盐酸 、 硫酸 、 potassium chloride 、 水 作用下， 反应 1.0h， 生成 5-Amino-2-brom-3,4-dimethylbenzolsulfonsaeure
  参考文献：
  名称：

  Zur合成磺化醚衍生物2,3-二甲基苯胺和3,4-二甲基苯胺†

  摘要：

  2,3-二甲基苯胺和3,4-二甲基苯胺的磺化衍生物的合成

  DOI：

  10.1002/hlca.19800630208
• 作为产物：
  描述：

  2,3-二甲基苯胺 在 溴 作用下， 生成 4-溴-2,3-二甲基乙酰苯胺
  参考文献：
  名称：

  Extensive sterile abscess in an invasive fibrous thyroiditis (Riedel’s thyroiditis) caused by an occlusive vasculitis

  摘要：

  Riedel's thyroiditis is a rare disease determined by an invasive fibrosclerotic transformation of the thyroid gland. It may be one manifestation of multifocal fibrosis with still unknown etiology. Because it mimics carcinoma, a biopsy must be performed to get the correct diagnosis. The condition is self-limiting when confined to the neck. Prognosis depends on the extent of extracervical fibrosclerosis. We present a patient with a huge cervical and mediastinal, unilateral thyroid mass expanding to the aortic curve, which led to tracheal deviation and compression with symptoms of strider and dyspnea. These symptoms continued under a course of high-dose steroids; thus an operation was necessary to relieve the airway obstruction and limit inflammation. Intraoperative and pathological findings showed an inflammatory infiltration of the adjacent neck muscles and a sterile abscess caused by an occlusive vasculitis. Therefore, hemithyroidectomy had to be performed instead of a local limited resection. (C)2001, Editrice Kurtis.

  DOI：

  10.1007/bf03343824

文献信息

• Condensed Thiophenes and Selenophenes:  Thionyl Chloride and Selenium Oxychloride as Sulfur and Selenium Transfer Reagents
  作者：Ramiya R. Amaresh、M. V. Lakshmikantham、Jeffrey W. Baldwin、Michael. P. Cava、Robert M. Metzger、Robin D. Rogers

  DOI：10.1021/jo010858m

  日期：2002.4.1

  give dicyano substituted thieno(3,4-c)thiophenes. The use of selenium oxychloride furnished the corresponding cyano substituted seleno(3,4-c)thiophene. 1,2-Phenylenediacetonitriles gave the corresponding cyano substituted benzo(c)thiophenes and benzo(c)selenenophenes, respectively, upon reaction with thionyl chloride and selenium oxychloride in the presence of base.

  3,4-氰基甲基取代的噻吩在碱的存在下与亚硫酰氯反应生成二氰基取代的噻吩并（3,4-c）噻吩。氯氧化硒的使用提供了相应的氰基取代的硒代（3,4-c）噻吩。在碱的存在下，与亚硫酰氯和氯氧化硒反应后，1,2-苯二乙腈分别生成相应的氰基取代的苯并（c）噻吩和苯并（c）硒代苯酚。
• Halogenation Using Quaternary Ammonium Polyhalides. XI. Bromination of Acetanilides by Use of Tetraalkylammonium Polyhalides
  作者：Shoji Kajigaeshi、Takaaki Kakinami、Hiromichi Yamasaki、Shizuo Fujisaki、Tsuyoshi Okamoto

  DOI：10.1246/bcsj.61.2681

  日期：1988.7

  The reaction of acetanilides with tetraalkylammonium polyhalides, such as tetrabutylammonium tribromide, benzyltrimethylammonium tribromide, and benzyltrimethylammonium chlorobromate(1–), in dichloromethane-methanol at room temperature gave bromosubstituted acetanilides in good yields, respectively.

  乙酰苯胺与四烷基多卤化铵（如四丁基三溴化铵、苄基三甲基三溴化铵和苄基三甲基氯溴酸铵（1-））在二氯甲烷-甲醇中在室温下反应，分别以良好的收率得到溴取代的乙酰苯胺。
• Aniline intermediates
  申请人：American Cyanamid Company

  公开号：US04404402A1

  公开（公告）日：1983-09-13

  There are provided novel substituted aniline intermediates, useful in the synthesis of certain substituted N-nitroanilines or salts thereof which may be used to elicit several desirable and advantageous biological responses in plants.

  提供了新型取代苯胺中间体，可用于合成某些取代N-硝基苯胺或其盐，这些化合物可用于引发植物中几种有益的生物反应。
• Thiadiazole compounds and methods of use
  申请人：Monenschein Holger

  公开号：US20080255145A1

  公开（公告）日：2008-10-16

  The invention relates to thiadiazole compounds useful for treating diseases mediated by protein kinase B (PKB). The invention also relates to the therapeutic use of such thiadiazole compounds and compositions thereof in treating disease states associated with abnormal cell growth, cancer, inflammation, and metabolic disorders.

  本发明涉及一种对蛋白激酶B（PKB）介导的疾病有用的噻二唑化合物。本发明还涉及在治疗与异常细胞生长、癌症、炎症和代谢障碍有关的疾病状态中使用这种噻二唑化合物及其组合物的治疗用途。
• Preparation of Isoxazolin-3-Ylacylbenzene
  申请人：Rheinheimer Joachim

  公开号：US20070161800A1

  公开（公告）日：2007-07-12

  A process is described for preparing isoxazoles of the formula I where the substituents are as defined below: R 1 is hydrogen, C 1 -C 6 -alkyl, R 2 is C 1 -C 6 -alkyl, R 3 , R 4 , R 5 are hydrogen, C 1 -C 6 -alkyl, or R 4 and R 5 together form a bond, R 6 is a heterocyclic ring, n is 0, 1 or 2; which comprises preparing an intermediate of the formula VI where R1, R3, R4 and R5 are as defined above, followed by halogenation, thiomethylation, oxidation and acylation to give compounds of the formula I. Also novel intermediates for preparing the compounds of the formula I and novel processes for preparing the intermediates are described.

  本发明涉及一种制备式I的异氧唑的方法，其中置换基如下所定义：R1为氢、C1-C6烷基，R2为C1-C6烷基，R3、R4、R5为氢、C1-C6烷基，或R4和R5一起形成键，R6为杂环，n为0、1或2。该方法包括制备式VI的中间体，其中R1、R3、R4和R5如上所定义，然后进行卤代、硫甲基化、氧化和酰化，以得到式I的化合物。本发明还描述了制备式I化合物的新型中间体和制备中间体的新型方法。