(4-氯-2-甲基苯基)丙酸酯 | 7463-55-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 中文名称: (4-氯-2-甲基苯基)丙酸酯
• 英文名称: propionic acid-(4-chloro-2-methyl-phenyl ester)
• 英文别名: Propionsaeure-(4-chlor-2-methyl-phenylester)；(4-Chlor-2-methyl-phenyl)-propionat；5-Chlor-2-propionyloxy-toluol；(4-Chloro-2-methylphenyl) propanoate
• CAS: 7463-55-0
• 化学式: C₁₀H₁₁ClO₂
• mdl: MFCD01757638
• 分子量: 198.649
• InChiKey: SRLZNGDIPYTDOY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 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-氯-2-甲基苯基)丙酸酯 在 三氯化铝 、 sodium acetate 作用下， 生成 6-chloro-2,3,8-trimethyl-chromen-4-one
  参考文献：
  名称：

  Chakravarti; Majumdar, Journal of the Indian Chemical Society, 1939, vol. 16, p. 151,155

  摘要：

  DOI：
• 作为产物：
  描述：

  4-氯-2-甲基苯酚 、 丙酰氯 在 magnesium 作用下， 以 苯 为溶剂， 反应 2.5h， 生成 (4-氯-2-甲基苯基)丙酸酯
  参考文献：
  名称：

  Synthesis and activity of 2-methyl-3-aminopropiophenones as centrally acting muscle relaxants

  摘要：

  Some novel 2-methyl-3-aminopropiophenones were synthesized and their centrally acting muscle relaxant activities were evaluated for an inhibitory effect on the flexor reflex in rats. The structure-activity relationships are discussed. In this series, 2-methyl-3-pyrrolidino-1-(4-trifluoromethylphenyl)-propan-1-one (28) showed significant centrally acting muscle relaxant activity. In addition, the activities of each enantiomer (28-(S) and (R)) were studied along with their acute toxicities. Compound 28-(R) was found to exhibit more potent activity and weaker acute toxicity than 28-(S). Accordingly, compound 28-(R) (NK433) is under development as a novel centrally acting muscle relaxant.

  DOI：

  10.1016/0223-5234(96)88213-4

文献信息

• Improved pesticide formulations
  申请人：Shell Agrar GmbH & Co. KG

  公开号：EP0235773A1

  公开（公告）日：1987-09-09

  The post-emergent control of a broad spectrum of pests is accomplished by the post-emergent application of a pesticidally effective amount of a formulation comprised of at least one post-emergent, foliar absorbed, substantially water insoluble active ingredient dispersed in at least one substantially water miscible polar/nonpolar solvent which has a vapor pressure of not more than 760 mm of Hg at 20°C capable of dissolving a plant cuticle, including the cuticular wax, and, optionally a surface active agent which substantially prevents the active ingredient from precipitating upon dilution of the formulation with water. The formulation is initially applied to the surface of the foliage and is subsequently incorporated therein by the dissolution of the waxy layer of the foliage by the polar/nonpolar solvent.

  利用后发生的控制广谱害虫的效果，通过施用一种有效量的杀虫剂配方来实现，该配方由至少一种后发性、叶面吸收、明显不溶于水的活性成分，分散在至少一种明显可溶于水的极性/非极性溶剂中组成，该溶剂在20°C时的蒸汽压不超过760毫米汞柱，能够溶解植物表皮，包括表皮蜡质，以及可选的表面活性剂，该表面活性剂在配方被稀释成水时，能够有效防止活性成分沉淀。该配方最初施于叶面表面，并随后通过极性/非极性溶剂溶解叶面的蜡质层而被吸收。
• Neue Oximäther, Verfahren zu ihrer Herstellungs, Mittel die die neuen Oximäther enthalten und ihre Verwendung
  申请人：CIBA-GEIGY AG

  公开号：EP0094348B1

  公开（公告）日：1985-07-24
• DURCHWURZELUNGSINHIBITOREN
  申请人：BAYER AG

  公开号：EP0801525A2

  公开（公告）日：1997-10-22
• HERBICIDAL COMPOSITIONS CONTAINING DMSO
  申请人：Smale, Bernard

  公开号：EP0804075A2

  公开（公告）日：1997-11-05
• OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS
  申请人：Huntsman Petrochemical Corporation

  公开号：EP2104422A2

  公开（公告）日：2009-09-30