3-甲基-5,6-二氢-1,4-二恶英-2-羧酸 | 135813-44-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二恶英
• 中文名称: 3-甲基-5,6-二氢-1,4-二恶英-2-羧酸
• 英文名称: 5,6-dihydro-3-methyl-1,4-dioxin-2-carboxylic acid
• 英文别名: 3-Methyl-5,6-dihydro-1,4-dioxine-2-carboxylic acid；6-methyl-2,3-dihydro-1,4-dioxine-5-carboxylic acid
• CAS: 135813-44-4
• 化学式: C₆H₈O₄
• mdl: MFCD08059728
• 分子量: 144.127
• InChiKey: WZTMMYVTLOVLJI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 海关编码：
  2932999099
• WGK Germany：
  3

反应信息

• 作为反应物：
  描述：

  3-甲基-5,6-二氢-1,4-二恶英-2-羧酸 在 氯化亚砜 作用下， 反应 1.5h， 生成 1,4-二恶英-2-甲酰氯，5,6-二氢-3-甲基-（9CI）
  参考文献：
  名称：

  Synthesis and Antifungal Activity of 5,6-Dihydro-3- methyl-1,4-dioxin-2-carboxamides

  摘要：

  Seven N-aryl-5,6-dihydro-3-methyl-1,4-dioxin-2-carboxamides were prepared as potential fungicides. The fungicidal activity of the dioxincarboxamides was evaluated against bean rust, a major disease of cereal crops. Structure-activity relationships for the screened compounds are discussed. The fungicidal activity of the dioxincarboxamides is correlated with that of the structurally similar commercial fungicide, carboxin.

  DOI：

  10.1021/jf970960d
• 作为产物：
  描述：

  2-甲基-5,6-二氢-1,4-二恶英 在 吡啶 、 氢氧化钾 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 31.0h， 生成 3-甲基-5,6-二氢-1,4-二恶英-2-羧酸
  参考文献：
  名称：

  Synthesis and Antifungal Activity of 5,6-Dihydro-3- methyl-1,4-dioxin-2-carboxamides

  摘要：

  Seven N-aryl-5,6-dihydro-3-methyl-1,4-dioxin-2-carboxamides were prepared as potential fungicides. The fungicidal activity of the dioxincarboxamides was evaluated against bean rust, a major disease of cereal crops. Structure-activity relationships for the screened compounds are discussed. The fungicidal activity of the dioxincarboxamides is correlated with that of the structurally similar commercial fungicide, carboxin.

  DOI：

  10.1021/jf970960d

文献信息

• Treatment of HIV infections and compounds useful therein
  申请人：Uniroyal Chemical Company, Inc.

  公开号：US05693827A1

  公开（公告）日：1997-12-02

  A method of inhibiting the growth or replication of viruses of the HIV group is disclosed. Also disclosed are compounds useful in the method and pharmaceutical formulations incorporating such compounds. The method involves the use of compounds having the general formula: ##STR1## wherein the substituent groups are as defined in the specification.

  本发明公开了一种抑制HIV病毒组的病毒生长或复制的方法。还公开了在该方法中有用的化合物和包含这些化合物的制药配方。该方法涉及使用具有一般式的化合物：##STR1##其中取代基团如规范中所定义。
• NRF2 SMALL MOLECULE INHIBITORS FOR CANCER THERAPY
  申请人：THE JOHNS HOPKINS UNIVERSITY

  公开号：US20160046616A1

  公开（公告）日：2016-02-18

  Small molecule inhibitors of Nrf2 and methods of their use are provided for treating or preventing a disease, disorder or condition associated with an Nrf2-regulated pathway. The compound can be administered as a single agent or can be administered to enhance the efficacy of a chemotherapeutic drug and/or radiation therapy.

  提供了Nrf2的小分子抑制剂及其使用方法，用于治疗或预防与Nrf2调节通路相关的疾病、疾患或病情。该化合物可以作为单一药剂使用，也可以用于增强化疗药物和/或放射治疗的疗效。
• Dioxo heterocyclic compounds, composition containing same and process
  申请人：Uniroyal Chemical Company, Inc.

  公开号：US05070211A1

  公开（公告）日：1991-12-03

  A compound having the structural formula ##STR1## where R is at least one of hydrogen, C.sub.1 -C.sub.4 alkyl, C.sub.1 -C.sub.4 alkoxy, halogen, cyano, phenyl, phenoxy, benzyl or COOR.sup.1 ; and R.sup.1 is C.sub.1 -C.sub.4 alkyl is disclosed. A composition comprising a growth regulant effective amount of the compound and a carrier therefor is also set forth. In addition, a process for regulating plant growth comprising applying a plant growth regulant effective amount of the compound to the locus of the plant whose growth is to be regulated is taught.

  揭示了一种具有结构式##STR1##的化合物，其中R至少是氢，C.sub.1-C.sub.4烷基，C.sub.1-C.sub.4烷氧基，卤素，氰基，苯基，苯氧基，苄基或COOR.sup.1中的至少一个；而R.sup.1是C.sub.1-C.sub.4烷基。此外，还提供了一种包含所述化合物和载体的生长调节剂有效量的组合物。此外，还教授了一种调节植物生长的方法，包括将所述化合物的植物生长调节剂有效量应用于需要调节生长的植物的部位。
• Bi-functional complexes and methods for making and using such complexes
  申请人：Gouliaev Alex Haahr

  公开号：US11225655B2

  公开（公告）日：2022-01-18

  The present invention is directed to a method for the synthesis of a bi-functional complex comprising a molecule part and an identifier oligonucleotide part identifying the molecule part. A part of the synthesis method according to the present invention is preferably conducted in one or more organic solvents when a nascent bi-functional complex comprising an optionally protected tag or oligonucleotide identifier is linked to a solid support, and another part of the synthesis method is preferably conducted under conditions suitable for enzymatic addition of an oligonucleotide tag to a nascent bi-functional complex in solution.

  本发明涉及一种合成双功能复合物的方法，该复合物包括分子部分和识别分子部分的识别寡核苷酸部分。根据本发明的合成方法的一部分优选在一种或多种有机溶剂中进行，此时包含可选保护标签或寡核苷酸标识符的新生双功能复合物与固体支持物相连接，合成方法的另一部分优选在适合于将寡核苷酸标签酶加到溶液中的新生双功能复合物的条件下进行。
• TREATMENT OF HIV INFECTIONS AND COMPOUNDS USEFUL THEREIN
  申请人：UNIROYAL CHEMICAL LTD./UNIROYAL CHEMICAL LTEE

  公开号：EP0497816A1

  公开（公告）日：1992-08-12