6-chloro-1,2,3,5-tetramethylbenzene | 26138-78-3

• 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: 6-chloro-1,2,3,5-tetramethylbenzene
• 英文别名: 2-chloro-1,3,4,5-tetramethyl-benzene；2-Chlor-1,3,4,5-tetramethyl-benzol；2,3,4,6-tetramethyl monochlorobenzene；1-Chlor-2,3,4,6-tetramethylbenzol；Chlor-isodurol；Chlorisodurol；2-Chloro-1,3,4,5-tetramethylbenzene
• CAS: 26138-78-3
• 化学式: C₁₀H₁₃Cl
• 分子量: 168.666
• InChiKey: NEXFARGVKNMECI-UHFFFAOYSA-N

物化性质

• 沸点：
  239.6±9.0 °C(Predicted)
• 密度：
  1.013±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  6-chloro-1,2,3,5-tetramethylbenzene 在 硫酸 作用下， 生成 6-chloro-1,2,3,4,5-pentamethylbenzene
  参考文献：
  名称：

  The Jacobsen Reaction. IV¹

  摘要：

  DOI：

  10.1021/ja01292a001
• 作为产物：
  描述：

  1,2,3,5-四甲基苯 在 碘 、 氯 、 溶剂黄146 作用下， 生成 6-chloro-1,2,3,5-tetramethylbenzene
  参考文献：
  名称：

  The Determination of Reactivities meta and para to Halogens. The Bromination of Some Halopolymethylbenzenes by Bromine in Nitromethane^1,2

  摘要：

  DOI：

  10.1021/ja01600a047

文献信息

• Orientation of the Products from the Nitration of Halopentamethylbenzenes
  作者：Hitomi Suzuki

  DOI：10.1246/bcsj.43.481

  日期：1970.2

  5-Halo-2,3,4,6-tetramethyl- and 6-halo-2,3,4,5-tetramethylbenzyl nitrate were the principal products. 4-Halo-2,3,5,6-tetramethylbenzyl nitrate was never formed in any significant amount. The orientation was consistent with the previously suggested mechanistic scheme. PMR spectral data for nine halotetramethylbenzyl chlorides and nitrates have been presented.

  已经研究了发烟硝酸对氯五甲基苯、溴五甲基苯和碘五甲基苯的作用。主要产品为硝酸5-卤-2,3,4,6-四甲基-及6-卤-2,3,4,5-四甲基苄基硝酸酯。4-Halo-2,3,5,6-四甲基苄基硝酸盐从未以任何显着量形成。方向与先前建议的机械方案一致。已经提供了九种卤代四甲基苄基氯和硝酸盐的 PMR 光谱数据。
• Syntheses of Diiodo and Triiodo Derivatives of 1,2,3-Trimethylbenzene (<i>Hemimellitene</i>) and 1,2,4-Trimethylbenzene (<i>Pseudocumene</i>). A Convenient Use of Polyiodo Derivatives for the Characterization of Polyalkylbenzenes and Their Derivatives
  作者：Hitomi Suzuki、Yasuhiro Haruta

  DOI：10.1246/bcsj.46.589

  日期：1973.2

  A complete set of diiodo and triiodo derivatives of 1,2,3-trimethylbenzene and 1,2,4-trimethylbenzene has been prepared and their physical properties are recorded. Use of polyiodo derivatives as a means for characterizing polyalkylbenzenes and their derivatives has been proposed.

  制备了一套完整的1,2,3-三甲基苯和1,2,4-三甲基苯的二碘和三碘衍生物并记录了它们的物理性质。已经提出使用多碘衍生物作为表征多烷基苯及其衍生物的手段。
• Structure Proof of Diarylmethanes Formed in the Jacobsen Reaction of Monochlorotetramethylbenzenes
  作者：Hitomi Suzuki

  DOI：10.1246/bcsj.42.2618

  日期：1969.9

  The Jacobsen reaction of monochlorotetramethylbenzenes was found to yield dichloroheptamethyldiphenylmethanes as by-product. Their indefinite structure proof was made on spectroscopy and synthesis. 1H NMR spectra for a variety of polymethyldiphenylmethanes and their chlorine derivatives were determined.

  发现一氯四甲基苯的 Jacobsen 反应产生作为副产物的二氯七甲基二苯基甲烷。它们的不确定结构证明是在光谱和合成上进行的。测定了多种聚甲基二苯基甲烷及其氯衍生物的 1 H NMR 光谱。
• PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF
  申请人：Kim Jae-Gyu

  公开号：US20070219230A1

  公开（公告）日：2007-09-20

  The present invention provides novel pyrrolo[2,3-c]pyridine derivatives or pharmaceutically acceptable salts thereof, processes for the preparation thereof, and compositions comprising the same. The pyrrolo[2,3-c]pyridine derivatives or pharmaceutically acceptable salts thereof of the present invention have excellent proton pump inhibition effects and possess the ability to attain a reversible proton pump inhibitory effect.

  本发明提供了新型吡咯并[2,3-c]吡啶衍生物或其药学上可接受的盐，其制备方法以及包含它们的组合物。本发明的吡咯并[2,3-c]吡啶衍生物或其药学上可接受的盐具有优异的质子泵抑制作用，并具有可逆的质子泵抑制作用。
• LUMINOGENIC AND FLUOROGENIC COMPOUNDS AND METHODS TO DETECT MOLECULES OR CONDITIONS
  申请人：Promega Corporation

  公开号：US20140154716A1

  公开（公告）日：2014-06-05

  A method to detect the presence or amount of at least one molecule in a sample which employs a derivative of luciferin or a derivative of a fluorophore is provided. Compounds and compositions for carrying out the methods of the invention are also provided.

  本发明提供了一种检测样本中至少一种分子存在或数量的方法，该方法采用了luciferin的衍生物或荧光团的衍生物。还提供了用于执行本发明方法的化合物和组合物。