methyl 1-(4-chlorophenyl)-1,4-dihydro-4-oxo-6-methyl pyridazine-3-carboxylate | 68253-83-8

• 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: methyl 1-(4-chlorophenyl)-1,4-dihydro-4-oxo-6-methyl pyridazine-3-carboxylate
• 英文别名: Methyl 1-(4-chlorophenyl)-1,4-dihydro-4-oxo-6-methylpyridazine-3-carboxylate；methyl 1-(4-chlorophenyl)-6-methyl-4-oxopyridazine-3-carboxylate
• CAS: 68253-83-8
• 化学式: C₁₃H₁₁ClN₂O₃
• 分子量: 278.695
• InChiKey: LTDSGGAYFVLDFN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  59
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  methyl 1-(4-chlorophenyl)-1,4-dihydro-4-oxo-6-methyl pyridazine-3-carboxylate 生成 Methyl 1-(4-Chlorophenyl)-1,4-dihydro-4-thioxo-6-methyl pyridazine-3-carboxylate
  参考文献：
  名称：

  FUJIMOTO, TED, T.

  摘要：

  DOI：
• 作为产物：
  描述：

  杀雄嗪 在 氯化亚砜 作用下， 生成 methyl 1-(4-chlorophenyl)-1,4-dihydro-4-oxo-6-methyl pyridazine-3-carboxylate
  参考文献：
  名称：

  Method of producing hybrid cereal grain seeds by application of

  摘要：

  式为##STR1##的化合物，其中R.sup.1是芳基或取代芳基，R.sup.2是烷基或芳基，R.sup.3是氢、烷基、芳基烷基或卤素，或R.sup.2和R.sup.3一起是--(CH.sub.2).sub.n --，其中n为3至8，Z是氧或硫，Y是基团Z'R.sup.4或NR.sup.5 R.sup.6，其中Z'是氧或硫，R.sup.4是氢、烷氧基烷基、烷基、环烷基、环烷基烷基、卤代烷基、苯基或苄基或阳离子，R.sup.5和R.sup.6独立地是氢或烷基，或当R.sup.5是氢时，R.sup.6是羟基或其烷基金属盐。这些化合物作为植物生长调节剂活性，特别是作为化学杂交剂。

  公开号：

  US04345934A1

文献信息

• Plant growth regulating 1-aryl-1,4-dihydro-4-oxo(thio)-pyridazines
  申请人：Rohm and Haas Company

  公开号：US04661145A1

  公开（公告）日：1987-04-28

  Compounds of the formula ##STR1## wherein R.sup.1 is aryl or substituted aryl, R.sup.2 is alkyl, or aryl, R.sup.3 is hydrogen, alkyl, aralkyl, or halogen, or R.sup.2 and R.sup.3 taken together are --(CH.sub.2).sub.n -- where n is 3 to 8 Z is oxygen or sulfur, and Y is the group Z'R.sup.4 or NR.sup.5 R.sup.6 wherein Z' is oxygen or sulfur, R.sup.4 is hydrogen or an agronomically acceptable salt thereof, alkoxyalkyl, alkyl, cycloalkyl, cycloalkylalkyl, haloalkyl, phenyl or benzyl or a cation R.sup.5 and R.sup.6 are independently hydrogen or alkali or when R.sup.5 is hydrogen, R.sup.6 is hydroxy or an alkyl metal salt thereof. These compounds are active as plant growth regulators, and particularly as chemical hybridization agents.

  化合物的公式为##STR1##其中，R.sup.1是芳基或取代芳基，R.sup.2是烷基或芳基，R.sup.3是氢、烷基、芳基烷基或卤素，或R.sup.2和R.sup.3结合在一起是--(CH.sub.2).sub.n--，其中n为3至8，Z为氧或硫，Y为Z'R.sup.4或NR.sup.5R.sup.6基团，其中Z'为氧或硫，R.sup.4为氢或其农学上可接受的盐、烷氧基烷基、烷基、环烷基、环烷基烷基、卤代烷基、苯基或苄基或阳离子，R.sup.5和R.sup.6独立地为氢或碱金属，当R.sup.5为氢时，R.sup.6为羟基或其烷基金属盐。这些化合物作为植物生长调节剂活性，特别是作为化学杂交剂。
• Process for the preparation of pyridazine derivatives
  申请人：ROHM AND HAAS COMPANY

  公开号：EP0025498A2

  公开（公告）日：1981-03-25

  A 1-aryl-1,4-dihydro-4-oxopyridazine carboxylic acid ester of the formula: is prepared by an improved process which comprises reacting, in a liquid medium and in the substantial absence of water available to undergo reaction to form undesired by-product(s), an alcohol with a hydrazone in the presence of (a) a strong acid catalyst and (b) a desiccant which serves to remove water of reaction. The alcohol used is of the formula ROH and the hydrazone used is of the for- In the above formulae: R is (C1-C6)alkyl, (C1-C4)alkoxy(C1C4)alkyl, (C3-C8)-cycloalkyl, (C3-C8)cycloalkyl(C1-C4)alkyl, halo(C,-C6)-alkyl, benzyl or benzyl the ring of which is substituted with up to two of the same or different substituents selected from chloro, bromo, methyl, ethyl, methoxy, cyano, nitro and trifluoromethyl; R1 and R2 are selected from hydrogen and (C1-C4)-alkyl; X is selected from halo, trihalomethyl, nitro, (C1-C4)-alkyl, (C1-C4)alkoxy, (C1-C4)alkylthio, (C1-C4)alkylsulfinyl, (C1-C4)alkylsulfonyl, cyano and carboxy, the X substituents being the same or different when n is > 1, and n is 0 or an integer of from 1-3. The esters of Formula I find use as plant growth regulators.

  式中的 1-芳基-1,4-二氢-4-氧哒嗪羧酸酯： 一种 1-芳基-1,4-二氢-4-氧哒嗪羧酸酯是用一种改进的工艺制备的，该 工艺包括在液体介质中，在基本上没有水的情况下，在(a)一种强酸催化剂和(b)一 种用于除去反应水的干燥剂的存在下，使一种醇与一种腙发生反应生成不需要的副产物。所用的醇的化学式为 ROH，所用的腙的化学式为 在上式中 R 是(C1-C6)烷基、(C1-C4)烷氧基(C1C4)烷基、(C3-C8)-环烷基、(C3-C8)环烷基(C1-C4)烷基、卤代(C,-C6)-烷基、苄基或其环最多被两个相同或不同的取代基取代的苄基，这些取代基选自氯、溴、甲基、乙基、甲氧基、氰基、硝基和三氟甲基； R1 和 R2 选自氢和 (C1-C4)- 烷基； X 选自卤、三卤甲基、硝基、(C1-C4)-烷基、(C1-C4)烷氧基、(C1-C4)烷硫基、(C1-C4)烷基亚磺酰基、(C1-C4)烷基磺酰基、氰基和羧基，当 n > 1 时，X 取代基相同或不同，n 为 0 或 1-3 的整数。 式 I 的酯类可用作植物生长调节剂。
• Pyridazinone compounds, process for their preparation, compositions containing them and a method of regulating the growth of plants, increasing the yield of soya bean plants and sterilizing the male anthers of plants, including small grain cereal plants, using them as well as a method of producing F1 hybrid seed
  申请人：SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V.

  公开号：EP0037133A1

  公开（公告）日：1981-10-07

  A compound of the general formula in which X represents an oxygen or sulphur atom; Y represents a hydrogen or halogen atom or an alkyl group; Z represents an alkyl group; Ar represents an optionally-substituted phenyl group; and R represents a group i) NR1R2 or ONR1R2, in which R' represents a hydrogen atom or an alkyl, alkenyl, alkynyl or cycloalkyl group and R' represents a hydrogen atom, an alkyl, alkenyl, alkynyl, cycloalkyl, alkoxy or hydroxy group, or an acyl group derived from a carboxylic or carbamic acid, or an alkyl group substituted with a carboxylic acid or ester group, or R' and R2 together with the interjacent nitrogen atom represent an optionally substituted heterocyclic ring; or ii) OR3 in which R3 represents an alkenyl, alkynyl, cycloalkyl or aryl group or an alkyl, alkenyl, alkynyl, cycloalkyl or aryl group substituted by one or more of the same or different substituents selected from halogen atoms, alkoxy, alkylthio, cyano and aryl groups, acyl groups derived from carboxlic or carbamic acids, groups of formula NR1R2 where R1 and R2 have the meaning given above, and carboxy groups and salts and esters thereof; or iii) SR4 in which R4 has one of the meanings given above for R3 or represents a hydrogen atom or an alkyl group; or iv) ON=CR4R5 in which R4 has the meaning given above and R5 has one of the meanings given above for R3 or represents an alkyl group, or R4 and R5 together with the interjacent carbon atom represent an optionally substituted carbocyclic or heterocyclic ring; or v) NR6NR7R8 in which each of R6 and R7 independently has one of the meanings given above for R1 and R8 has one of the meanings given above for R' or represents an acyl group derived from a carboxylic acid or R7 and R8 together with the interjacent nitrogen atom represent an optionally substituted heterocyclic ring; have useful plant growth regulating properties.

  通式如下的化合物 其中 X 代表氧原子或硫原子； Y 代表氢原子、卤素原子或烷基； Z 代表烷基； Ar 代表一个任选取代的苯基；以及 R 代表一个基团 i) NR1R2 或 ONR1R2，其中 R' 代表氢原子或烷基、烯基、炔基或环烷基，而 R' 代表氢原子、烷基、烯基、炔基、环烷基、烷氧基或羟基，或来自羧酸或氨基甲酸的酰基，或被羧酸或酯基取代的烷基，或 R' 和 R2 连同相邻的氮原子代表任选取代的杂环；或 OR3 其中 R3 代表烯基、炔基、环烷基或芳基，或被一个或多个相同或不 同取代基取代的烷基、烯基、炔基、环烷基或芳基，这些取代基可选 自卤素原子、烷氧基、烷硫基、氰基和芳基、源自羧酸或氨基甲酸的酰基、 式 NR1R2（其中 R1 和 R2 具有上述含义）基团、羧基及其盐和酯类；或 其中 R4 具有上述 R3 的含义之一，或代表氢原子或烷基；或 iv) ON=CR4R5 其中 R4 具有上述含义，R5 具有上述 R3 的含义之一，或代表烷基，或 R4 和 R5 连同相邻碳原子代表任选取代的碳环或杂环；或 v) NR6NR7R8，其中 R6 和 R7 各自独立地具有上述 R1 的含义之一，R8 具有上述 R' 的含义之一，或代表从羧酸衍生的酰基，或 R7 和 R8 连同相邻的氮原子代表任选取代的杂环；具有有效的植物生长调节特性。
• FUJIMOTO, TED, T.
  作者：FUJIMOTO, TED, T.

  DOI：——

  日期：——
• US4345934A
  申请人：——

  公开号：US4345934A

  公开（公告）日：1982-08-24