methyl α-chloro-α-(methylthio)acetate | 62383-81-7

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: methyl α-chloro-α-(methylthio)acetate
• 英文别名: α-chloro-α-(methylthio)-acetate；α-chloro-α-(methylthio)acetate；methyl 2-chloro-2-(methylsulfanyl)acetate；α-chloro-2-(methylthio)acetate；methyl 2-chloro-2-(methylthio)acetate；methyl chloro(methylthio)acetate；methyl 2-chloro-2-methylsulfanylacetate
• CAS: 62383-81-7
• 化学式: C₄H₇ClO₂S
• 分子量: 154.617
• InChiKey: RBVGCZYERHDACP-UHFFFAOYSA-N

物化性质

• 沸点：
  169.0±25.0 °C(Predicted)
• 密度：
  1.249±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  8
• 可旋转键数：
  3
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  51.6
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  methyl α-chloro-α-(methylthio)acetate 、 8-methylquinazolin-6-ol 在 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 4.0h， 以62%的产率得到methyl 2-(8-methylquinazolin-6-yl)oxy-2-methylsulfanyl-acetate
  参考文献：
  名称：

  Synthesis and anti-oomycete activity of novel quinazolin- and benzothiazol-6-yloxyacetamides: Potent aza-analogs and five-ring analogs of quinoline fungicides

  摘要：

  Novel quinazolin-and benzothiazol-6-yloxyacetamides show excellent in vivo activity against the three economically most important Oomycete pathogens Phytophthora infestans, Plasmopara viticola and Pythium ultimum. They are polar analogs of known quinolin-6-yloxyacetamides, which are not active against the soil-borne damping-off disease caused by Pythium ultimum. The Bogert quinazoline synthesis, an almost forgotten heterocyclization technique, proved to be highly useful for the concise construction of required quinazolin-6-ol building blocks. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2015.08.009
• 作为产物：
  描述：

  甲基硫代乙酸甲酯 在 磺酰氯 作用下， 以 二氯甲烷 为溶剂， 生成 methyl α-chloro-α-(methylthio)acetate
  参考文献：
  名称：

  FUNGICIDES

  摘要：

  通式为（公式），其中取代基如权利要求（1）所定义的化合物，可用作杀真菌剂。

  公开号：

  US20100056570A1

文献信息

• [EN] QUINOLINE DERIVATIVES AS FUNGICIDES<br/>[FR] DÉRIVÉS DE QUINOLÉINE UTILISÉS EN TANT QUE FONGICIDES
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2011154240A1

  公开（公告）日：2011-12-15

  Compounds of the general formula (I) wherein the substituents are as defined in claim 1, are useful as fungicides.

  通式（I）中取代基如权利要求1所定义的化合物，可用作杀真菌剂。
• [EN] NOVEL AMIDES AS FUNGICIDES<br/>[FR] NOUVEAUX AMIDES UTILES COMME FONGICIDES
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2011144444A1

  公开（公告）日：2011-11-24

  Compounds of the general formula (I), wherein the substituents are as defined in claim 1, are useful as fungicides.

  通式(I)的化合物，其中取代基如权利要求书中所定义，可用作杀菌剂。
• Synthesis of optically active 6-substituted 2-(aminomethyl)chromans
  作者：Mingbao Zhang、Raymond Reeves、Cheng Bi、Robert Dally、Gaetan Ladouceur、William Bullock、Jefferson Chin

  DOI：10.1016/j.tetlet.2004.05.037

  日期：2004.6

  Three novel, optically active, 6-substituted 2-(aminomethyl)chromans were synthesized from readily available chroman 2-carboxylic acid precursors. These chroman-containing primary amines are useful building blocks for the synthesis of chroman-derived pharmaceutical agents.

  从容易获得的苯并二氢吡喃2-羧酸前体合成了三种新型的旋光的6-取代的2-（氨基甲基）苯并吡喃。这些含苯并二氢吡喃的伯胺是合成苯并二氢吡喃衍生物的有用试剂。
• Quinoline derivatives as fungicides
  申请人：Syngenta Participations AG

  公开号：EP2397467A1

  公开（公告）日：2011-12-21

  Compounds of the general formula wherein the substituents are as defined in claim 1, are useful as fungicides.

  通式为的化合物，其中取代基如权利要求书中定义的那样，可用作杀真菌剂。
• Synthesis of novel 3,4,6-trisubstituted quinolines enabled by a Gould-Jacobs cyclization
  作者：Stephan Trah、Clemens Lamberth

  DOI：10.1016/j.tetlet.2017.01.042

  日期：2017.2

  several novel, so far undescribed 3,4,6-trisubstituted quinoline derivatives. They all bear substituents which are well-suited for further transformations, e.g. carboxylic acid or ester functions, halogens, terminal alkynes and hydroxyl groups. The synthesis of a highly active 3,4-disubstituted quinolin-6-yloxyacetamide fungicide gives proof of the manifold manipulations which are possible with these interesting

  Gould-Jacobs环化使得能够合成几种新颖的，迄今未描述的3,4,6-三取代喹啉衍生物。它们均带有非常适合进一步转化的取代基，例如羧酸或酯官能团，卤素，末端炔烃和羟基。高活性的3,4-二取代的喹啉-6-基氧基乙酰胺类杀菌剂的合成证明了这些有趣的杂环双环砌块可能进行的多种操作。