methyl (E)-2-methyl-3-(phenylthio)-2-propenoate | 71847-74-0

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: methyl (E)-2-methyl-3-(phenylthio)-2-propenoate
• 英文别名: methyl (E)-2-methyl-3-phenylthio-prop-2-enoate；(E)-methyl 2-methyl-3-(phenylthio)-2-propenoate；methyl (E)-2-methyl-3-phenylsulfanylprop-2-enoate
• CAS: 71847-74-0
• 化学式: C₁₁H₁₂O₂S
• 分子量: 208.281
• InChiKey: VJWSHPTURZGJFU-CMDGGOBGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.18
• 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 (E)-2-methyl-3-(phenylthio)-2-propenoate 、 苯甲酰氯 生成
  参考文献：
  名称：

  甲基 3-LITHIO-2-METHYL-3-PENYLTHIO-2-PROPENOATE 作为两性离子三碳加成物；与羰基化合物的反应

  摘要：

  使用 α,β-烯酸酯和醛，3-lithio-2-methyl-3-phenylthio-2-propenoate 进行加成和环化，分别产生官能化的环戊烯酮和丁烯内酯。与酰氯反应生成γ-酮-α,β-烯酸酯。

  DOI：

  10.1246/cl.1979.785
• 作为产物：
  描述：

  甲基丙烯酸甲酯 在 三乙胺 N-氯代丁二酰亚胺 、 三乙胺 作用下， 反应 3.5h， 生成 methyl (E)-2-methyl-3-(phenylthio)-2-propenoate
  参考文献：
  名称：

  Oxidative functionalization of the .beta.-carbon in .alpha.,.beta.-unsaturated systems. Preparation of 3-phenylthio enones, acrylates, and other vinyl derivatives

  摘要：

  DOI：

  10.1021/jo00315a002

文献信息

• [EN] ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME<br/>[FR] COMPOSÉ IMIDATE À INSATURATION ?, ? ET COMPOSITION PESTICIDE LE CONTENANT
  申请人：SUMITOMO CHEMICAL CO

  公开号：WO2009064031A1

  公开（公告）日：2009-05-22

  There is provided a compound having an excellent controlling effect on pests, represented by the formula (I): wherein, A and E independently represent a -R1 group, a -L1-R1 group, etc.; G represents a -L2-R1 group, a -S(O)2-R4 group, etc.; X represents a -S-R5 group or a -O-R6 group; Z represents an optionally substituted carbocyclic group or an optionally substituted heterocyclic group; R1 represents an optionally substituted C1-C20 chain hydrocarbon group, etc.; R5 represents a substituted C1-C4 alkyl group, an optionally substituted C5-C10 alkyl group, etc.; R6 represents a substituted C1-C2 alkyl group, an optionally substituted C3-C10 alkyl group, etc.; L1 represents a an oxygen atom, a sulfur atom, a -S(O)- group, or a -S(O)2- group; and L2 represents an oxygen atom or a sulfur atom.

  提供一种在害虫上具有优异控制效果的化合物，其表示为以下结构式（I）：其中，A和E分别代表一个-R1基团，一个-L1-R1基团等；G代表一个-L2-R1基团，一个-S(O)2-R4基团等；X代表一个-S-R5基团或一个-O-R6基团；Z代表一个可选择取代的碳环基团或一个可选择取代的杂环基团；R1代表一个可选择取代的C1-C20链烃基团等；R5代表一个取代的C1-C4烷基基团，一个可选择取代的C5-C10烷基基团等；R6代表一个取代的C1-C2烷基基团，一个可选择取代的C3-C10烷基基团等；L1代表一个氧原子，一个硫原子，一个-S(O)-基团，或一个-S(O)2-基团；L2代表一个氧原子或一个硫原子。
• A total synthesis of (±)-methylenomycin A
  作者：Yasuhiro Takahashi、Kôhei Isobe、Hisahiro Hagiwara、Hiroshi Kosugi、Hisashi Uda

  DOI：10.1039/c39810000714

  日期：——

  A new synthesis of (±)-methylenomycin A (1) has been accomplished by applying the cyclisation reaction between the vinyl-lithium reagent (2) and methyl acrylate as the key step.

  通过应用乙烯基锂试剂（2）和丙烯酸甲酯之间的环化反应作为关键步骤，完成了（±）-甲基新霉素A（1）的新合成。
• IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL
  申请人：Kamiyama Hideo

  公开号：US20100210683A1

  公开（公告）日：2010-08-19

  There is provided a compound having an excellent controlling effect on arthropod pests represented by the formula (I-1): wherein Z represents an optionally substituted carbocyclic group or an optionally substituted heterocyclic group; G represents a -A 1 -R 1 group, etc.; X 0 represents a -A 2 -R 4 group, etc.; X represents a -A 2 -R 4 group, etc.; X 0 represents a -A 3 -R 6 group, etc.; or X and X 0 are optionally taken together to form a -A 2 -T 0 -A 3 - group; M 1 represents a —R 8 group, etc.; A 1 , A 2 and A 3 independently represent an oxygen atom, etc.; R 1 and R 8 independently represents an optionally substituted C1-C20 chain hydrocarbon group, etc.; R 4 and R 6 independently represent an optionally substituted C1-C6 chain hydrocarbon group, etc.; and T 0 represents an optionally substituted C2-C6 alkanediyl group.

  提供一种化合物，它对于以式(I-1)所代表的节肢动物害虫具有优异的控制效果：其中Z代表可选取代的碳环基团或可选取代的杂环基团；G代表-A1-R1基团等；X0代表-A2-R4基团等；X代表-A2-R4基团等；X0代表-A3-R6基团等；或X和X0可选地结合形成-A2-T0-A3-基团；M1代表-R8基团等；A1、A2和A3独立地代表氧原子等；R1和R8独立地代表可选取代的C1-C20链烃基团等；R4和R6独立地代表可选取代的C1-C6链烃基团等；而T0代表可选取代的C2-C6脂肪二基基团。
• ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME
  申请人：Itoh Shigeyuki

  公开号：US20100240729A1

  公开（公告）日：2010-09-23

  There is provided a compound having an excellent controlling effect on pests, represented by the formula (I): wherein, A and E independently represent a —R 1 group, a -L 1 -R 1 group, etc.; G represents a -L 2 -R 1 group, a —S(O) 2 —R 4 group, etc.; X represents a —S—R 5 group or a —O—R 6 group; Z represents an optionally substituted carbocyclic group or an optionally substituted heterocyclic group; R 1 represents an optionally substituted C1-C20 chain hydrocarbon group, etc.; R 5 represents a substituted C1-C4 alkyl group, an optionally substituted C5-C10 alkyl group, etc.; R 6 represents a substituted C1-C2 alkyl group, an optionally substituted C3-C10 alkyl group, etc.; L 1 represents a an oxygen atom, a sulfur atom, a —S(O)— group, or a —S(O) 2 -group; and L 2 represents an oxygen atom or a sulfur atom.

  提供一种具有优异的害虫控制效果的化合物，其化学式表示为（I）：其中，A和E独立地表示—R1基团、-L1-R1基团等；G表示-L2-R1基团、—S（O）2—R4基团等；X表示—S—R5基团或—O—R6基团；Z表示可选取代的碳环基团或可选取代的杂环基团；R1表示可选取代的C1-C20链烃基团等；R5表示取代的C1-C4烷基团、可选取代的C5-C10烷基团等；R6表示取代的C1-C2烷基团、可选取代的C3-C10烷基团等；L1表示氧原子、硫原子、—S（O）—基团或—S（O）2—基团；L2表示氧原子或硫原子。
• Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same
  申请人：Sumitomo Chemical Company, Limited

  公开号：US08278473B2

  公开（公告）日：2012-10-02

  There is provided a compound having an excellent controlling effect on pests, represented by the formula (I): wherein, A and E independently represent a —R1 group, a -L1-R1 group, etc.; G represents a -L2-R1 group, a —S(O)2—R4 group, etc.; X represents a —S—R5 group or a —O—R6 group; Z represents an optionally substituted carbocyclic group or an optionally substituted heterocyclic group; R1 represents an optionally substituted C1-C20 chain hydrocarbon group, etc.; R5 represents a substituted C1-C4 alkyl group, an optionally substituted C5-C10 alkyl group, etc.; R6 represents a substituted C1-C2 alkyl group, an optionally substituted C3-C10 alkyl group, etc.; L1 represents a an oxygen atom, a sulfur atom, a —S(O)— group, or a —S(O)2— group; and L2 represents an oxygen atom or a sulfur atom.

  提供一种具有优异的害虫控制效果的化合物，其化学式为(I)：其中，A和E分别表示-R1基团、-L1-R1基团等；G表示-L2-R1基团、-S(O)2-R4基团等；X表示-S-R5基团或-O-R6基团；Z表示可选取代的碳环基团或可选取代的杂环基团；R1表示可选取代的C1-C20链烃基团等；R5表示取代的C1-C4烷基团、可选取代的C5-C10烷基团等；R6表示取代的C1-C2烷基团、可选取代的C3-C10烷基团等；L1表示氧原子、硫原子、-S(O)基团或-S(O)2基团；L2表示氧原子或硫原子。