N-((6-氯吡啶-3-基)甲基)-N-乙基-1-(甲硫基)-2-硝基乙烯胺 | 120740-46-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 中文名称: N-((6-氯吡啶-3-基)甲基)-N-乙基-1-(甲硫基)-2-硝基乙烯胺
• 英文名称: N-((6-chloropyridin-3-yl)methyl)-N-ethyl-1-(methylthio)-2-nitroethenamine
• 英文别名: N-(6-chloropyridin-3-yl)methylene-N-ethyl-1-(methylthio)-2-nitrovinylidene amine；N-((6-chloropyridin-3-yl)methyl)-N-ethyl-1-(methylthio)-2-nitrovinylamine；N-[(6-chloropyridin-3-yl)methyl]-N-ethyl-1-methylsulfanyl-2-nitroethenamine
• CAS: 120740-46-7
• 化学式: C₁₁H₁₄ClN₃O₂S
• 分子量: 287.77
• InChiKey: WBWJDFFVJWYQPH-UHFFFAOYSA-N

物化性质

• 沸点：
  425.9±45.0 °C(Predicted)
• 密度：
  1.302±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  87.2
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  N-((6-氯吡啶-3-基)甲基)-N-乙基-1-(甲硫基)-2-硝基乙烯胺 在 三氟化硼乙醚 作用下， 以 乙醇 、 乙腈 为溶剂， 反应 4.0h， 生成 6-(((6-chloropyridin-3-yl)methyl)(ethyl)amino)-1-methyl-5-nitro-1,2,3,4-tetrahydropyridin-2-ol
  参考文献：
  名称：

  Design, Synthesis, and Particular Biological Behaviors of Chain-Opening Nitromethylene Neonicotinoids with Cis Configuration

  摘要：

  On the basis of the structure of heterocyclic-fused cis configuration derivatives and chain-opening neonicotinoids, two series of novel chain-opening tetrahydropyridine analogues were designed and synthesized. The preliminary bioassay tests were determined on cowpea aphid (Aphis craccivora) and armyworm (Pseudaletia separata Walker). The results showed that some of the target compounds exhibited repellent effects, whereas others showed good insecticidal activities.

  DOI：

  10.1021/jf203068a
• 作为产物：
  描述：

  2-氯-5-氯甲基吡啶 以 乙醇 、 乙腈 为溶剂， 反应 11.5h， 生成 N-((6-氯吡啶-3-基)甲基)-N-乙基-1-(甲硫基)-2-硝基乙烯胺
  参考文献：
  名称：

  含氮杂环化合物及其用途

  摘要：

  本发明涉及一种结构新颖的含氮杂环类化合物及其用途。所述含氮杂环化合物为式Ⅰ所示化合物(详见说明书)，或其在农药学上可接受的盐。本发明提供的含氮杂环类化合物可作为杀虫剂应用。与现有杀虫剂相比，本发明提供的杀虫剂的化学稳定性更好，同时，对于抗性害虫具有更好的杀灭活性。

  公开号：

  CN105669660B

文献信息

• NITROGENOUS HETEROCYCLIC COMPOUNDS WITH INSECTICIDAL ACTIVITY, AND THE PREPARATION AND USE THEREOF
  申请人：Li Zhong

  公开号：US20100298346A1

  公开（公告）日：2010-11-25

  The present invention relates to nitro-containing heterocyclic or ring-opening nitrogenous compounds of formula (A), wherein R 1 , R 2 , R 3 , R 4 , R 5 , Y, Z, and W are as defined in the specification. The present invention discloses the preparation and the uses of a novel insecticide. Said compound and the derivatives thereof have high insecticidal activity to farm insects including homoptera and Lepidoptera pests, such as aphis, fulgorides, aleyrodids, leafhopper, commom thrips, cotton bollworm, cabbage caterpillar, cabbage moth, cotton leafworm, armyworn and so on.

  本发明涉及具有以下结构式（A）的含硝基杂环或开环含氮化合物，其中R1、R2、R3、R4、R5、Y、Z和W如规范中所定义。本发明揭示了一种新型杀虫剂的制备和用途。所述化合物及其衍生物对包括同翅目和鳞翅目害虫在内的农作物害虫具有高杀虫活性，如蚜虫、食蝽、粉虱、叶蝉、普通蓟马、棉铃虫、甘蓝青虫、甘蓝夜蛾、棉叶虫、军蠶等。
• Heterocyclic nitrogenous or oxygenous compounds with insecticidal activity formed from dialdehydes and their preparation and uses thereof
  申请人：Li Zhong

  公开号：US08563546B2

  公开（公告）日：2013-10-22

  The heterocyclic nitrogenous or oxygenous compounds of formula (A), (B), (C) or (D) formed from dialdehydes, their optical isomers, cis- and trans-isomers, or agrochemically acceptable salts, their preparation methods, agrochemical compositions comprising the compounds and the uses thereof are provided. The compounds and their derivatives have high insecticidal activities to several farming and forestry pests including homoptera and lepidoptera pests, such as aphis, fulgorid, whitefly, leafhopper, common thrips, cotton bollworm, cabbage caterpillar, cabbage moth, cotton leafworm, armyworm and so on.

  提供由二醛(A)、(B)、(C)或(D)形成的杂环氮或氧化合物，它们的光学异构体、顺反异构体或农药可接受的盐，它们的制备方法，包括这些化合物的农药组成物及其用途。这些化合物及其衍生物对几种农林害虫具有高度的杀虫活性，包括同翅目和鳞翅目害虫，如蚜虫、叶蝉、白粉虱、飞虱、普通蓟马、棉铃虫、卷叶蛾、甘蓝蛾、棉叶虫、斜纹夜蛾等。
• NITROGENOUS HETEROCYCLIC COMPOUND WITH INSECTICIDAL ACTIVITY AND ITS PREPARATION AND USE
  申请人：East China University of Science and Technology

  公开号：EP2281812B1

  公开（公告）日：2014-01-22
• HETEROCYCLIC NITROGENOUS OR OXYGENOUS COMPOUNDS WITH INSECTICIDAL ACTIVITY FORMED FROM DIALDEHYDES AND THEIR PREPARATION AND USES THEREOF
  申请人：East China University of Science and Technology

  公开号：EP2377845B1

  公开（公告）日：2015-01-28