1-(4-Chloro-benzyl)-1,3-dimethyl-thiourea | 90875-71-1

• 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: 1-(4-Chloro-benzyl)-1,3-dimethyl-thiourea
• 英文别名: N-(4-chlorobenzyl)-N-methyl-N'-methylthiourea；1-[(4-chlorophenyl)methyl]-1,3-dimethylthiourea
• CAS: 90875-71-1
• 化学式: C₁₀H₁₃ClN₂S
• mdl: MFCD29485647
• 分子量: 228.746
• InChiKey: SNBIKXSKBWPIID-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  47.4
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-(4-Chloro-benzyl)-1,3-dimethyl-thiourea 、 sodium;hydride 、 、 碘甲烷 在 四氢呋喃 、 水 、 氯化钠 、 乙酸乙酯 、 magnesium sulfate 作用下， 以 四氢呋喃 为溶剂， 反应 1.75h， 以to give 5.11 g of crude S-methyl-N-(4-chlorobenzyl)-N-methyl-N'-methylisothiourea as a colorless--pale yellow oil的产率得到S-methyl-N-(4-chloro-benzyl)-N-methyl-N'-methylisothiourea
  参考文献：
  名称：

  .alpha.-unsaturated amines, their production and use

  摘要：

  本文描述了公式为：##STR1##的.alpha.-不饱和胺，其中X.sup.1和X.sup.2是这样的，其中一个是电子吸引基团，另一个是氢原子或电子吸引基团；R.sup.1是通过氮原子连接的基团；R.sup.2是氢原子或通过碳、氮或氧原子连接的基团；n是等于0、1或2的整数；A是杂环基团或环烃基团，以及它们的盐和它们作为杀虫和/或杀螨剂的农药用途。

  公开号：

  US06124297A1

文献信息

• Alpha-unsaturated amine pyridine compounds
  申请人：Takeda Chemical Industries, Ltd.

  公开号：US05175301A1

  公开（公告）日：1992-12-29

  .alpha.-Unsaturated amines of the formula: ##STR1## wherein X.sup.1 and X.sup.2 are such that one is an electron-attracting group with the other being a hydrogen atom or an electron-attracting group; R.sup.1 is a group attached through a nitrogen atom; R.sup.2 is a hydrogen atom or a group attached through a carbon, nitrogen or oxygen atom; n is an integer equal to 0, 1 or 2; A is a heterocyclic group or a cyclic hydrocarbon group, and salts thereof and their agrochemical use as insecticidal and/or miticidal agents are described.

  本文描述了化学式为：##STR1##的.alpha.-不饱和胺，其中X.sup.1和X.sup.2是电子吸引基团，其中一个是氢原子或电子吸引基团，R.sup.1是通过氮原子连接的基团，R.sup.2是氢原子或通过碳、氮或氧原子连接的基团，n是等于0、1或2的整数，A是杂环基团或环烃基团，以及它们的盐和它们作为杀虫和/或杀螨剂的农药用途。
• Halogen substituted 5-thiazole methane amine compounds
  申请人：Takeda Chemical Industries, Ltd.

  公开号：US05214152A1

  公开（公告）日：1993-05-25

  .alpha.-Unsaturated amines of the formula: ##STR1## wherein X.sup.1 and X.sup.2 are such that one is an electron-attracting group with the other being a hydrogen atom or an electron-attracting group; R.sup.1 is a group attached through a nitrogen atom; R.sup.2 is a hydrogen atom or a group attached through a carbon, nitrogen or oxygen atom; n is an integer equal to 0, 1 or 2; A is a heterocyclic group or a cyclic hydrocarbon group, and salts thereof and their agrochemical use as insecticidal and/or miticidal agents are described.

  本发明涉及一种以下式子的.alpha.-不饱和胺：##STR1## 其中X.sup.1和X.sup.2是这样的，其中一个是吸电子基团，另一个是氢原子或吸电子基团；R.sup.1是通过氮原子连接的基团；R.sup.2是氢原子或通过碳、氮或氧原子连接的基团；n是等于0、1或2的整数；A是杂环基团或环烃基团，以及它们的盐和作为杀虫和/或杀螨剂的农药用途。
• &agr;-unsaturated amines, their production and use
  申请人：Takeda Chemical Industries, Ltd.

  公开号：US06407248B1

  公开（公告）日：2002-06-18

  &agr;-Unsaturated amines of the formula: wherein X1 and X2 are such that one is an electron-attracting group with the other being a hydrogen atom or an electron-attracting group; R1 is a group attached through a nitrogen atom; R2 is a hydrogen atom or a group attached through a carbon, nitrogen or oxygen atom; n is an integer equal to 0, 1 or 2; A is a heterocyclic group or a cyclic hydrocarbon group, and salts thereof and their agrochemical use as insecticidal and/or miticidal agents are described.

  本发明涉及一种&agr;-不饱和胺，其化学式为：其中X1和X2是这样的，一个是电子吸引基团，另一个是氢原子或电子吸引基团；R1是通过氮原子连接的基团；R2是氢原子或通过碳、氮或氧原子连接的基团；n是等于0、1或2的整数；A是杂环基团或环烃基团，以及它们的盐和作为杀虫剂和/或螨虫剂的农药用途的描述。
• Alpha-unsaturated amines, their production and use
  申请人：Takeda Chemical Industries, Ltd.

  公开号：EP0302389A2

  公开（公告）日：1989-02-08

  α-Unsaturated amines of the formula: wherein X¹ and X² are such that one is an electron-­attracting group with the other being a hydrogen atom or an electron-attracting group; R¹ is a group attached through a nitrogen atom; R² is a hydrogen atom or a group attached through a carbon, nitrogen or oxygen atom; n is an integer equal to 0, 1 or 2; A is a heterocyclic group or a cyclic hydrocarbon group, and salts thereof and their agrochemical use as insecticidal and/or miticidal agents are described.

  式中α-不饱和胺： 式中：X¹和X²一个是引电子基团，另一个是氢原子或引电子基团；R¹是通过氮原子连接的基团；R²是氢原子或通过碳原子、氮原子或氧原子连接的基团；n是等于0、1或2的整数；A是杂环基团或环烃基团；描述了其盐类及其作为杀虫剂和/或杀螨剂的农用化学品用途。
• Intermediates, their production and their use for preparing alpha-unsaturated amines
  申请人：TAKEDA CHEMICAL INDUSTRIES, LTD.

  公开号：EP0529680A2

  公开（公告）日：1993-03-03

  α-unsaturated amines of the formula: wherein X¹ and X² are such that one is an electron-attracting group with the other being a hydrogen atom or an electron-attracting group; R¹ is a group attached through a nitrogen atom; R² is a hydrogen atom or a group attached through a carbon, nitrogen or oxygen atom; n is an integer equal to 0, 1 or 2; A is a heterocyclic group or a cyclic hydrocarbon group, and salts thereof and their agrochemical use as insecticidal and/or miticidal agents are described.

  式中α-不饱和胺： 其中，X¹和X²一个是引电子基团，另一个是氢原子或引电子基团；R¹是通过氮原子连接的基团；R²是氢原子或通过碳原子、氮原子或氧原子连接的基团；n是等于0、1或2的整数；A是杂环基团或环烃基团。