3,4-dichlorophenylmaleic anhydride | 41374-09-8

• 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: 3,4-dichlorophenylmaleic anhydride
• 英文别名: (3,4-Dichlor-phenyl)-maleinsaeure-anhydrid；(3,4-dichloro-phenyl)-maleic acid anhydride；3-(3,4-Dichlorophenyl)-2,5-furandione；(3,4-dichlorophenyl)furan-2,5-dione；3-(3,4-dichlorophenyl)furan-2,5-dione
• CAS: 41374-09-8
• 化学式: C₁₀H₄Cl₂O₃
• 分子量: 243.046
• InChiKey: MTSQSXQZNMKXPV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  43.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3,4-dichlorophenylmaleic anhydride 在 叠氮基三甲基硅烷 作用下， 以 1,4-二氧六环 为溶剂， 反应 4.0h， 生成 4-(3,4-Dichlorphenyl)-2H-1,3(3H)oxazin-2,6-dion
  参考文献：
  名称：

  MacMillan,J.H.; Washburne,S.S., Journal of Heterocyclic Chemistry, 1975, vol. 12, p. 1215 - 1220

  摘要：

  DOI：
• 作为产物：
  描述：

  3,4-二氯苯乙腈 在 甲酸 、 硫酸 、 potassium carbonate 作用下， 以 甲醇 为溶剂， 反应 8.0h， 生成 3,4-dichlorophenylmaleic anhydride
  参考文献：
  名称：

  Condensation of arylacetonitriles with glyoxylic acid. Facile synthesis of arylmaleic acid derivatives

  摘要：

  DOI：

  10.1021/jo00079a044

文献信息

• Fungicides containing pyrrolidones as their active agents
  申请人：BASF Aktiengesellschaft

  公开号：US06476061B1

  公开（公告）日：2002-11-05

  The invention relates to fungicides containing compounds of formula (I) as their active agents, the radicals in said formula (I) having the following meanings: R1 is hydrogen, C1-C6-alkyl, C1-C6-alkylcarbonyl, formyl or C1-C6-halogenalkylcarbonyl; R2 is hydrogen, C1-C6-alkyl or C1-C6-halogenalkyl; R3-R12 are hydrogen, halogen, C1-C8-cycloalkyl, C1-C6-alkyl, C1-C6-halogenalkyl, C1-C6-alkoxy, C1-C6-halogenalkoxy, C1-C6-alkylsulfonyl, C1-C6-halogenalkylsulfonyl, formyl, cyano, C1-C6-alkylthio or phenyl which can optionally be substituted by halogen atoms, C1-C6-alkyl or C1-C6-halogenalkyl groups, and to their agriculturally usable salts. The invention also relates to methods for combating fungi in plants using these fungicides.

  该发明涉及含有式(I)化合物作为其活性剂的杀菌剂，其中式(I)中的基团具有以下含义：R1为氢、C1-C6-烷基、C1-C6-烷基羰基、甲酰基或C1-C6-卤代烷基羰基；R2为氢、C1-C6-烷基或C1-C6-卤代烷基；R3-R12为氢、卤素、C1-C8-环烷基、C1-C6-烷基、C1-C6-卤代烷基、C1-C6-烷氧基、C1-C6-卤代烷氧基、C1-C6-烷基磺酰基、C1-C6-卤代烷基磺酰基、甲酰基、氰基、C1-C6-烷基硫基或苯基，苯基可以选择性地被卤素原子、C1-C6-烷基或C1-C6-卤代烷基基团取代，并且还涉及其在农业上可用的盐。该发明还涉及使用这些杀菌剂在植物中对抗真菌的方法。
• Synthesis and Pharmacological Characterization of Bicyclic Triple Reuptake Inhibitor 3-Aryl Octahydrocyclopenta[<i>c</i>]pyrrole Analogues
  作者：Liming Shao、Michael C. Hewitt、Scott C. Malcolm、Fengjiang Wang、Jianguo Ma、Una C. Campbell、Nancy A. Spicer、Sharon R. Engel、Larry W. Hardy、Zhi-Dong Jiang、Rudy Schreiber、Kerry L. Spear、Mark A. Varney

  DOI：10.1021/jm101312a

  日期：2011.8.11

  The present work expands the chemical space known to offer potent inhibition of the serotonin transporter (SERT), norepinephrine transporter (NET), and dopamine transporter (DAT) and discloses novel bicyclic octahydrocyclopenta[c]pyrrole and octahydro-1H-isoindole scaffolds as potent triple reuptake inhibitors (TRIs) for the potential treatment of depression. Optimized compounds 22a (SEAT, NET, DAT, IC(50) = 20, 109, 430 nM), 23a (SERT, NET, DAT, IC(50) = 29, 85, 168 nM), and 26a (SERT, NET, DAT, IC(50) = 53, 150, 140 nM) were highly brain penetrant, active in vivo in the mouse tail suspension test at 10 and 30 mpk PO, and were not generally motor stimulants at doses ranging from 1 to 30 mpk PO. Moderate in vitro cytochrome P450 (CYP) and potassium ion channel Kv11.1 (hERG) inhibition were uncovered as potential liabilities for the chemical series.
• DE870106
  申请人：——

  公开号：——

  公开（公告）日：——
• Preparation of the 5,6-arene oxide of 3,3',4,4'-tetrachlorobiphenyl. Decarboxylative elimination as an effective last step
  作者：Ieva L. Reich、Hans J. Reich

  DOI：10.1021/jo00295a008

  日期：1990.4
• REICH, IEVA L.;REICH, HANS J., J. ORG. CHEM., 55,(1990) N, C. 2282-2283
  作者：REICH, IEVA L.、REICH, HANS J.

  DOI：——

  日期：——