4-chloro-6-(1-fluoroethyl)-5-iodopyrimidine | 245651-75-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 4-chloro-6-(1-fluoroethyl)-5-iodopyrimidine
• 英文别名: 4-Chloro-6-(1-fluoro-ethyl)-5-iodopyrimidine
• CAS: 245651-75-6
• 化学式: C₆H₅ClFIN₂
• 分子量: 286.475
• InChiKey: QHQLARFUTJXZOQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  25.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-chloro-6-(1-fluoroethyl)-5-iodopyrimidine 、 4-叔-丁基苄胺 在 三乙胺 作用下， 以 甲苯 为溶剂， 反应 3.0h， 生成 4-(4-t-butylbenzylamino)-6-(1-fluoro-ethyl)-5-iodopyrimidine
  参考文献：
  名称：

  6-(1-FLUOROETHYL)-5-IODO-4-AMINOPYRIMIDINE COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME, AND PEST CONTROLLERS FOR AGRICULTURAL AND HORTICULTURAL USE

  摘要：

  公开号：

  EP1357113B1
• 作为产物：
  描述：

  6-(1-fluoroethyl)-5-iodo-4-pyrimidone 在 氯化亚砜 、 sodium hydroxide 作用下， 以 乙酸乙酯 、 N,N-二甲基甲酰胺 、 水 为溶剂， 反应 3.0h， 生成 4-chloro-6-(1-fluoroethyl)-5-iodopyrimidine
  参考文献：
  名称：

  6-(1-FLUOROETHYL)-5-IODO-4-AMINOPYRIMIDINE COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME, AND PEST CONTROLLERS FOR AGRICULTURAL AND HORTICULTURAL USE

  摘要：

  公开号：

  EP1357113B1

文献信息

• Agri-Horticultural Pest Control Compositions Comprising 4-(3-Butynyl)Aminopyrimidine Derivatives
  申请人：Sakai Masaaki

  公开号：US20130296271A1

  公开（公告）日：2013-11-07

  Agri-horticultural pest control compositions having outstanding control effect on pests, in particular, agri-horticultural pests, which comprise as active ingredients one or more 4-(3-butynyl)aminopyrimidine derivatives represented by the general formula [I], namely, where R 1 is typically selected from among: a) phenyl c) —SiR 5 R 6 R 7 (R 5 , R 6 , and R 7 which may be the same or different represent a linear or branched alkyl having 1-6 carbon atoms, a linear or branched haloalkyl having 1-3 carbon atoms which is substituted by one halogen atom, a linear or branched cyanoalkyl having 1-3 carbon atoms which is substituted by one cyano group, and phenyl); d) hydropgen atom; R 2 typically represents a hydrogen atom; R 3 typically represents a hydrogen atom; R 4 represents a hydrogen atom and one or more agri-horticultural pest control compounds selected from among agri-horticultural antimicrobial compounds, say, multi-site contact active compouns, nucleic acids synthesis inhibitory active compounds, mitosis and cell divesion inhibitory active compounds, and/or agri-horticultural insecticidal, miticidal or nematicidal compounds, say, acetylcholinesterase inhibitors, GABA-gated chloride antagonists, and sodium channel modulators. Since the 4-(3-butynyl)aminopyrimidine derivatives and the existing antimicrobial active compounds and/or insecticidal active compounds are used in admixture, the 4-(3-butynyl)aminopyrimidine derivatives which are useful as pest control agents, particularly as agri-horticultural pest control agents, need be used in smaller amounts and yet their antimicrobial or insecticidal activity can be improved.

  农业园艺害虫控制组合物对害虫，特别是农业园艺害虫具有杰出的控制效果，其活性成分包括一种或多种由通式[I]表示的4-(3-丁炔基)氨基嘧啶衍生物，其中R1通常从以下中选择：a)苯基；b) -SiR5R6R7（R5、R6和R7可以相同也可以不同，代表具有1-6个碳原子的直链或支链烷基，具有1-3个碳原子的直链或支链卤代烷基，被一个卤原子取代，具有1-3个碳原子的直链或支链氰基烷基，被一个氰基取代，以及苯基）；d)氢原子；R2通常表示氢原子；R3通常表示氢原子；R4表示氢原子以及一种或多种从农业园艺抗微生物化合物中选择的农业园艺害虫控制化合物，比如，多位点接触活性化合物，核酸合成抑制活性化合物，有丝分裂和细胞分裂抑制活性化合物，和/或农业园艺杀虫、杀螨或杀线虫化合物，比如，乙酰胆碱酯酶抑制剂，GABA门控氯离子拮抗剂和钠通道调节剂。由于4-(3-丁炔基)氨基嘧啶衍生物和现有的抗微生物活性化合物和/或杀虫活性化合物混合使用，因此作为害虫控制剂，特别是作为农业园艺害虫控制剂有用的4-(3-丁炔基)氨基嘧啶衍生物需要以较小的量使用，但其抗微生物或杀虫活性可以得到改善。
• 5-Iodo-4-phenethylaminopyrimidine derivative, intermediate thereof, processes for producing the same and agricultural and horticultural pesticides
  申请人：UBE Industries, Ltd.

  公开号：US06521627B1

  公开（公告）日：2003-02-18

  The present invention is to provide a novel 5-iodo-4-phenethylaminopyrimidine derivative represented by the following formula (1): wherein R1 represents a halogen atom, a C2-4 acyloxy group or a hydroxyl group; R2 represents a hydrogen atom, a halogen atom, a C1-4 alkyl group, a C1-4 haloalkyl group, a C1-4 alkoxy group or a C1-4 haloalkoxy group; n is an integer of 1 to 3; and * represents an asymmetric carbon atom, useful as pesticides, a synthetic intermediate thereof and processes for producing these compounds, and pesticides containing the 5-iodo-4-phenethylaminopyrimidine derivative(s).

  本发明提供了一种新型的5-碘-4-苯乙基氨基嘧啶衍生物，其化学式表示如下（1）：其中R1代表卤素原子，C2-4酰氧基或羟基；R2代表氢原子，卤素原子，C1-4烷基，C1-4卤代烷基，C1-4烷氧基或C1-4卤代烷氧基；n为1至3的整数；*代表一个不对称碳原子，可用作杀虫剂，其合成中间体和生产这些化合物的过程，以及含有5-碘-4-苯乙基氨基嘧啶衍生物的杀虫剂。
• 6-(1-fluoroethyl)-5-iodo-4-aminopyrimidine compounds process for preparation of the same and pest controllers for agricultural and horticultural use
  申请人：——

  公开号：US20040063945A1

  公开（公告）日：2004-04-01

  The present invention relates to a 6-(1-fluoroethyl)-5-iodo-4-aminopyrimidine compound represented by the following formula (1): 1 wherein Ar represents a phenyl group, a naphthyl group, a thienyl group, an indanyl group or a 1,4-benzodioxan-6-yl group, which is unsubstituted or substituted by 1 to 3 substituents selected from the group consisting of a halogen atom, an alkyl group having 1 to 4 carbon atoms, a haloalkyl group having 1 to 4 carbon atoms, an alkoxy group having 1 to 4 carbon atoms, a haloalkoxy group having 1 to 4 carbon atoms and a phenoxy group; R represents a hydrogen atom or an alkyl group having 1 to 4 carbon atoms; *1 represents an asymmetric carbon atom; *2 represents an asymmetric carbon atom when R represents an alkyl group having 1 to 4 carbon atoms, a process for preparing the same, and agricultural and horticultural chemicals for controlling noxious organisms.

  本发明涉及一种由以下式（1）表示的6-（1-氟乙基）-5-碘-4-氨基嘧啶化合物：1其中Ar代表苯基、萘基、噻吩基、茚基或1,4-苯并二氧杂环[6]基，该基团未取代或被1至3个取自卤素原子、1至4个碳原子的烷基、1至4个碳原子的卤代烷基、1至4个碳原子的烷氧基、1至4个碳原子的卤代烷氧基和苯氧基的基团所取代；R代表氢原子或1至4个碳原子的烷基；*1代表不对称碳原子；当R代表1至4个碳原子的烷基时，*2代表不对称碳原子；以及制备该化合物的方法和用于控制有害生物的农业和园艺化学品。
• 4-(3-Butynyl)Aminopyrimidine Derivatives as Pest Control Agents for Agricultural and Horticultural Use
  申请人：Sakai Masaaki

  公开号：US20120136150A1

  公开（公告）日：2012-05-31

  Novel 4-(3-butynyl)aminopyrimidine derivatives represented by general formula [I] are useful as pest control agents. In general formula [I], R 1 is a mono- or bi-cyclic ring which may contain 0 to 3 heteroatoms, for example, phenyl or oxazolyl; R 2 is a hydrogen atom, —R, —OR, —C(O)OR, —C(O)NHR, —CONR 2 (wherein R is straight-chain or branched C 1-8 alkyl, or the like), hydroxyalkyl, or the like; R 3 is a hydrogen atom, a halogen atom, acyloxy represented by (straight-chain or branched C 1-8 aliphatic hydrocarbon group) —CO—O—, or the like; and R 4 is a hydrogen atom, a halogen atom, C 1-6 alkyl, or the like, or alternatively, R 4 and R 3 together with the carbon atoms on the pyrimidine ring may form a thiophene ring, a pyrrole ring, an imidazole ring, a benzene ring, a pyrimidine ring, a furan ring, a pyrazine ring, or a pyrrolidine ring.

  通式[I]所表示的新型4-(3-丁炔基)氨基嘧啶衍生物可用作杀虫剂。在通式[I]中，R1是一个单环或双环环，可能含有0至3个杂原子，例如苯基或噁唑基；R2是氢原子，-R，-OR，-C（O）OR，-C（O）NHR，-CONR2（其中R是直链或支链C1-8烷基等），羟基烷基或类似物；R3是氢原子，卤素原子，酰氧基（由（直链或支链C1-8脂肪烃基）-CO-O-等表示），或类似物；R4是氢原子，卤素原子，C1-6烷基或类似物，或者，R4和R3与嘧啶环上的碳原子一起形成噻吩环，吡咯环，咪唑环，苯环，嘧啶环，呋喃环，吡嗪环或吡咯烷环。
• 5-IODO-4-PHENETHYLAMINOPYRIMIDINE DERIVATIVES, INTERMEDIATES THEREOF, PROCESS FOR PRODUCING THE SAME AND AGRICULTURAL/HORTICULTURAL PESTICIDES
  申请人：Ube Industries, Ltd.

  公开号：EP1074546A1

  公开（公告）日：2001-02-07

  The present invention is to provide a novel 5-iodo-4-phenethylaminopyrimidine derivative represented by the following formula (1): wherein R1 represents a halogen atom, a C2-4 acyloxy group or a hydroxyl group; R2 represents a hydrogen atom, a halogen atom, a C1-4 alkyl group, a C1-4 haloalkyl group, a C1-4 alkoxy group or a C1-4 haloalkoxy group; n is an integer of 1 to 3; and * represents an asymmetric carbon atom, useful as pesticides, a synthetic intermediate thereof and processes for producing these compounds, and pesticides containing the 5-iodo-4-phenethylaminopyrimidine derivative(s).

  本发明旨在提供下式（1）所代表的新型 5-碘-4-苯乙胺嘧啶衍生物： 其中 R1 代表卤原子、C2-4 乙酰氧基或羟基；R2 代表氢原子、卤原子、C1-4 烷基、C1-4 卤烷基、C1-4 烷氧基或 C1-4 卤烷氧基；n 为 1 至 3 的整数；* 代表不对称碳原子、 可用作杀虫剂、其合成中间体和生产这些化合物的工艺，以及含有 5-碘-4-苯乙基氨基嘧啶衍生物的杀虫剂。