5-tert-butyl-1,3-dimethylpyrazole | 82755-47-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-tert-butyl-1,3-dimethylpyrazole
• CAS: 82755-47-3
• 化学式: C₉H₁₆N₂
• 分子量: 152.239
• InChiKey: YHLDCNVXXHTZAE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  17.8
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  甲基肼 、 5-amino-2,2-dimethylhex-4-en-3-one 以 二甲基亚砜 为溶剂， 反应 16.0h， 以72%的产率得到5-tert-butyl-1,3-dimethylpyrazole
  参考文献：
  名称：

  Scope and Limitations in the Regioselective Synthesis of 1,3,5-Trisubstituted Pyrazoles from b-Amino Enones and Hydrazine Derivatives. 13C-Chemical Shift Prediction Rules for 1,3,5-Trisubstituted Pyrazoles

  摘要：

  DOI：

  10.3987/com-00-9102

文献信息

• [EN] BICYCLIC CARBOXYLATES AS MODULATORS OF TRANSPORTERS AND USES THEREOF<br/>[FR] CARBOXYLATES BICYCLIQUES UTILISÉS EN TANT QUE MODULATEURS DE TRANSPORTEURS ET LEURS UTILISATIONS
  申请人：NIROGY THERAPEUTICS INC

  公开号：WO2021061929A1

  公开（公告）日：2021-04-01

  The present invention generally relates to the field of transporter modulators, e.g., monocarboxylate transporter inhibitors, and more particularly to new bicyclic enone carboxylate compounds, the synthesis and use of these compounds and their pharmaceutical compositions, e.g., in the treatment, modulation and/or prevention of physiological conditions associated with monocarboxylate transporter activity such as in treating cancer and other neoplastic disorders, tissue and organ transplant rejection.

  本发明通常涉及转运体调节剂领域，例如单羧酸转运体抑制剂，更具体地涉及新的双环烯酮羧酸酯化合物，这些化合物的合成和使用以及它们的药物组合物，例如在治疗、调节和/或预防与单羧酸转运体活性相关的生理状况，如治疗癌症和其他肿瘤性疾病、组织和器官移植排斥等方面的应用。
• Biphenyl-Substituted Spirocyclic Ketoenols
  申请人：Bretschneider Thomas

  公开号：US20110306499A1

  公开（公告）日：2011-12-15

  The invention relates to novel compounds of the formula (I) in which W, X, Y, Z and CKE have the meanings given above, to a plurality of processes and intermediates for their preparation and to their use as pesticides and/or herbicides, and also to selective herbicidal compositions comprising, firstly, the compounds of the formula (I) and, secondly, at least one crop plant compatibility-improving compound. The invention further relates to the boosting of the action of crop protection compositions comprising compounds of the formula (I) through the additions of ammonium salts or phosphonium salts and optionally penetrants.

  该发明涉及以下式(I)的新化合物： 其中 W、X、Y、Z和CKE具有上述给定的含义，以及它们的制备的多种方法和中间体，以及它们作为杀虫剂和/或除草剂的用途，还涉及包括第一，式(I)的化合物和第二，至少一种作物植物相容性改进化合物的选择性除草组合物。 该发明还涉及通过添加铵盐或磷盐以及可选的渗透剂来增强包含式(I)的化合物的作物保护组合物的作用。
• Halogen Alkoxy Spirocyclic Tetramic and Tetronic Acid Derivatives
  申请人：Fischer Reiner

  公开号：US20100279873A1

  公开（公告）日：2010-11-04

  The invention relates to novel haloalkoxyspirocyclic tetramic and tetronic acid derivatives of the formula (I) in which W, X, Y, Z, A, D, Q 1 , Q 2 , m and G have the meanings given above, to a plurality of processes and intermediates for their preparation, and to their use as pesticides and/or herbicides. Moreover, the invention provides selective herbicidal compositions comprising, firstly, haloalkoxyspirocyclic tetramic and tetronic acid derivatives and, secondly, a crop plant compatibility-improving compound. The invention furthermore relates to increasing the action of crop protection compositions comprising compounds of the formula (I) through the addition of ammonium salts or phosphonium salts and optionally penetrants.

  该发明涉及公式（I）的新型卤代烷氧螺环四酮和四酸衍生物， 其中W、X、Y、Z、A、D、Q1、Q2、m和G具有上述给定的含义， 以及用于它们的制备的多种过程和中间体，以及它们作为杀虫剂和/或除草剂的用途。 此外，该发明提供了包括首先卤代烷氧螺环四酮和四酸衍生物，其次是一种改善作物植物相容性的化合物的选择性除草剂组合物。 该发明还涉及通过添加铵盐或磷盐以及可选的渗透剂来增强包含公式（I）化合物的作物保护组合物的作用。
• Alkoxyalkyl-Substituted Cyclic Keto-Enols
  申请人：Fischer Reiner

  公开号：US20090298828A1

  公开（公告）日：2009-12-03

  The invention relates to new alkoxyalkyl-substituted cyclic ketoenols of the formula (I) in which A, B, D, G, W, X, Y and Z have the definitions indicated above, to a number of processes and intermediates for their preparation, and to their use as pesticides and/or herbicides and/or microbicides. The invention further provides selectively herbicidal, compositions which comprise alkoxyalkyl-substituted cyclic ketoenols on the one hand and a crop plant tolerance promoter compound on the other. The invention further relates to the boosting of the action of crop protection compositions comprising compounds of the formula (I) through the additions of ammonium salts or phosphonium salts and optionally penetration promoters.

  该发明涉及公式（I）中A、B、D、G、W、X、Y和Z具有上述定义的新烷氧基烷基取代的环烯醇化合物，以及它们的制备过程和中间体，以及它们作为杀虫剂和/或除草剂和/或微生物杀灭剂的用途。该发明还提供了一种选择性除草剂，其中一方包括烷氧基烷基取代的环烯醇化合物，另一方包括作物植物耐受促进剂化合物的组合物。该发明还涉及通过添加铵盐或磷盐以及可选的渗透促进剂来增强包含公式（I）化合物的作物保护组合物的作用。
• CIS-ALKOXYSPIROCYCLIC BIPHENYL-SUBSTITUTED TETRAMIC ACID DERIVATIVES
  申请人：Fischer Reiner

  公开号：US20110130284A1

  公开（公告）日：2011-06-02

  The invention relates to novel compounds of the formula (I) in which W, X, Y, Z, A and G have the meanings given above, to a plurality of processes and intermediates for their preparation and to their use as pesticides and/or herbicides, and also to selective herbicidal compositions comprising, firstly, the cis-alkoxyspirocyclic biphenyl-substituted tetramic acid derivatives of the formula (I) and, secondly, at least one crop plant compatibility-improving compound. The invention relates furthermore to increasing the activity of crop protection compositions comprising compounds of the formula (I) by adding ammonium or phosphonium salts and, if appropriate, penetrants.

  该发明涉及公式（I）中W、X、Y、Z、A和G具有上述给定含义的新化合物，以及用于它们的制备的多种过程和中间体，以及它们作为杀虫剂和/或除草剂的用途，还涉及包括首先为公式（I）的顺式烷氧基螺环双苯取代四酰胺衍生物，其次为至少一种作物植物相容性改进化合物的选择性除草剂组合物。此外，该发明还涉及通过添加铵盐或膦盐以及必要时的渗透剂来增加包含公式（I）化合物的作物保护组合物的活性。