(4-chloro-2-methylphenoxy)acetone | 167087-92-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: (4-chloro-2-methylphenoxy)acetone
• 英文别名: 1-(4-chloro-2-methylphenoxy)propan-2-one
• CAS: 167087-92-5
• 化学式: C₁₀H₁₁ClO₂
• mdl: MFCD16151324
• 分子量: 198.649
• InChiKey: VTEMWEPAEPCECX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  (4-chloro-2-methylphenoxy)acetone 在 sodium tetrahydroborate 、 氯化亚砜 、 sodium ethanolate 、 potassium carbonate 、 溶剂黄146 、 三乙胺 作用下， 以 甲醇 、 乙醇 、 二氯甲烷 、 丙酮 、 苯 为溶剂， 反应 40.0h， 生成 5-(4-Chloro-2-methylphenoxy)-1-cyclopropyl-2-(phenoxymethyl)pyridin-4-one
  参考文献：
  名称：

  Discovery of a potent enoyl-acyl carrier protein reductase (FabI) inhibitor suitable for antistaphylococcal agent

  摘要：

  We report the discovery, synthesis, and biological activities of phenoxy-4-pyrone and phenoxy-4-pyridone derivatives as novel inhibitors of enoyl-acyl carrier protein reductase (FabI). Pyridone derivatives showed better activities than pyrone derivatives against FabI and Staphylococcus aureus strains, including methicillin-resistant Staphylococcus aureus (MRSA). Among the pyridone derivatives, compound 16l especially exhibited promising activities against the MRSA strain and good pharmacokinetic profiles. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2015.08.077
• 作为产物：
  描述：

  4-氯-2-甲基苯酚 、 一氯丙酮 在 potassium carbonate 作用下， 以 丙酮 为溶剂， 反应 16.0h， 生成 (4-chloro-2-methylphenoxy)acetone
  参考文献：
  名称：

  Discovery of a potent enoyl-acyl carrier protein reductase (FabI) inhibitor suitable for antistaphylococcal agent

  摘要：

  We report the discovery, synthesis, and biological activities of phenoxy-4-pyrone and phenoxy-4-pyridone derivatives as novel inhibitors of enoyl-acyl carrier protein reductase (FabI). Pyridone derivatives showed better activities than pyrone derivatives against FabI and Staphylococcus aureus strains, including methicillin-resistant Staphylococcus aureus (MRSA). Among the pyridone derivatives, compound 16l especially exhibited promising activities against the MRSA strain and good pharmacokinetic profiles. (C) 2015 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2015.08.077

文献信息

• Amino-acid amide derivatives, agricultural or horticultural fungicides,
  申请人：Kumiai Chemical Industry Co., Ltd.

  公开号：US05574064A1

  公开（公告）日：1996-11-12

  The present invention provides an agricultural or horticultural fungicide including an effective amount of an amino-acid derivative represented by the formula: ##STR1## wherein R.sup.1 represents a lower alkyl group (optionally having at least one same or different substituent of a halogen atom, an alkoxy group, and a cyano group), R.sup.2 represents an ethyl group, or an n-propyl group, R.sup.3 represents a hydrogen atom or a lower alkyl group, R.sup.4 represents a hydrogen atom, R.sup.5, R.sup.6, and R.sup.7 independently represent a hydrogen atom or a lower alkyl group, R.sup.8 represents a hydrogen atom, or a lower alkyl group, Z.sup.1 and Z.sup.2 independently represent an oxygen atom or a sulfur atom, Z.sup.3 represents an oxygen atom, or a sulfur atom, Q represents a phenyl group, m represents an integer from 0 to 2, and n represents 0 or 1. The amino-acid amide derivatives according to the present invention exhibit superior control of cucumber downy mildew (Pseudoperonospora cubensis), tomato late blight (Phytophthora infestans), and grape downy mildew (Plasmopara viticola), and are effective for potato late blight (Phytophthora infestans). In addition, the agricultural or horticultural fungicides of the present invention are also characterized in that they are not harmful chemicals and exhibit excellent characteristics such as systemic action, residual activity, and persistence after rain-fall.

  本发明提供了一种农业或园艺杀菌剂，包括一种由以下式表示的氨基酸衍生物的有效量：##STR1##其中R.sup.1代表较低的烷基基团（可选地至少具有一个相同或不同的卤原子、烷氧基和氰基取代基），R.sup.2代表乙基基团或正丙基基团，R.sup.3代表氢原子或较低的烷基基团，R.sup.4代表氢原子，R.sup.5、R.sup.6和R.sup.7独立地代表氢原子或较低的烷基基团，R.sup.8代表氢原子或较低的烷基基团，Z.sup.1和Z.sup.2独立地代表氧原子或硫原子，Z.sup.3代表氧原子或硫原子，Q代表苯基，m代表从0到2的整数，n代表0或1。根据本发明的氨基酸酰胺衍生物表现出对黄瓜霜霉病（Pseudoperonospora cubensis）、番茄晚疫病（Phytophthora infestans）和葡萄霜霉病（Plasmopara viticola）的优越控制，并且对马铃薯晚疫病（Phytophthora infestans）有效。此外，本发明的农业或园艺杀菌剂还具有不含有害化学物质的特点，并表现出系统作用、残留活性和雨后持久性等优异特性。
• Amino-acid amide derivatives, method for producing the same, and
  申请人：Kumiai Chemical Industry Co., Ltd.

  公开号：US05811424A1

  公开（公告）日：1998-09-22

  The present invention provides an amino-acid amide derivative represented by the formula: ##STR1## (wherein R.sup.1 represents a lower alkyl group (optionally having at least one same or different substituent of a halogen atom), R.sup.2 represents an ethyl group, R.sup.3 represents a hydrogen atom, R.sup.4 represents a hydrogen atom, R.sup.5, R.sup.6, and R.sup.7 independently represent a hydrogen atom or a lower alkyl group, R.sup.8 represents a hydrogen atom, Z.sup.1 and Z.sup.2 independently represent an oxygen atom or a sulfur atom, Z.sup.3 represents an oxygen atom or a sulfur atom, Q represents a phenyl group, m represents an integer from 0 to 2, and n represents 0 or 1), and an agricultural or horticultural fungicide including an effective amount of the same. The amino-acid amide derivatives exhibit a superior control of plant diseases, particularly downy mildew and late blight, and are not harmful to plants.

  本发明提供一种氨基酸酰胺衍生物，其表示为公式：##STR1## （其中，R.sup.1表示较低的烷基（可选地具有至少一个相同或不同的卤素原子取代基），R.sup.2表示乙基基团，R.sup.3表示氢原子，R.sup.4表示氢原子，R.sup.5、R.sup.6和R.sup.7独立地表示氢原子或较低的烷基，R.sup.8表示氢原子，Z.sup.1和Z.sup.2独立地表示氧原子或硫原子，Z.sup.3表示氧原子或硫原子，Q表示苯基，m表示0至2的整数，n表示0或1），以及包括有效量的农业或园艺杀菌剂。该氨基酸酰胺衍生物表现出优越的植物病害控制能力，特别是对霜霉病和晚疫病，且对植物无害。
• AMINO ACID AMIDE DERIVATIVE, AGROHORTICULTURAL BACTERICIDE, AND PRODUCTION PROCESS
  申请人：KUMIAI CHEMICAL INDUSTRY CO., LTD.

  公开号：EP0648740B1

  公开（公告）日：1997-10-08
• HERBICIDAL COMPOSITION CONTAINING 4-AMINO-3-CHLORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR DERIVATIVES THEREOF, FLUROXYPYR OR DERIVATIVES THEREOF, AND PHENOXY AUXINS OR DERIVATIVES THEREOF
  申请人：DOW AGROSCIENCES LLC

  公开号：US20150196030A1

  公开（公告）日：2015-07-16

  Provided herein are herbicidal compositions comprising a mixture comprising (a) 4-amino-3-chloro-6-(4-chloro-2-fluoro-3-methoxyphenyl)pyridine-2-carboxylic acid or an agriculturally acceptable ester, amide, or salt thereof, (b) fluroxypyr or an agriculturally acceptable ester, amide, or salt thereof, and (c) MCPA or 2,4-D or agriculturally acceptable esters, amides, or salts thereof. The compositions provide synergistic weed control of undesirable vegetation in areas including, but not limited to, cereals, rice, range and pasture areas, industrial vegetation management (IVM), and rights-of-way.
• US5574064A
  申请人：——

  公开号：US5574064A

  公开（公告）日：1996-11-12