4-isopropyl-4'-nitrobenzophenone | 40292-18-0

• 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: 4-isopropyl-4'-nitrobenzophenone
• 英文别名: p-Isopropyl-p'-nitrobenzophenon；(4-nitrophenyl)-(4-propan-2-ylphenyl)methanone
• CAS: 40292-18-0
• 化学式: C₁₆H₁₅NO₃
• 分子量: 269.3
• InChiKey: JNBDAKKBGPZEQT-UHFFFAOYSA-N

物化性质

• 熔点：
  96-98 °C
• 沸点：
  418.4±38.0 °C(Predicted)
• 密度：
  1.173±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  62.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-isopropyl-4'-nitrobenzophenone 在 盐酸 、 tin(ll) chloride 作用下， 以 乙醇 、 苯 为溶剂， 反应 5.0h， 生成 1-(2,6-dichloro-benzoyl)-3-[4-(4-isopropyl-benzoyl)-phenyl]-urea
  参考文献：
  名称：

  Studies on the insecticidal activities of some newN-benzoyl-N′-arylureas

  摘要：

  AbstractThis paper reports the synthesis and the insecticidal activities of some N‐benzoyl‐N'‐arylureas 4‐arylsubstituted with alkylated or halogenated aroyl moieties. The compounds, tested against some representative insect species, displayed very high activity against Aedes aegypti, especially the halosubstituted derivatives. None of the newly synthesized compounds showed genotoxic activity in the Bacillus subtilis rec‐assay and in the Salmonella‐microsome test.

  DOI：

  10.1002/ps.2780450306
• 作为产物：
  描述：

  异丙苯 、 4-硝基苯甲酰氯 在 三氯化铝 作用下， 以 1,2-二氯乙烷 为溶剂， 反应 3.0h， 以80%的产率得到4-isopropyl-4'-nitrobenzophenone
  参考文献：
  名称：

  Studies on the insecticidal activities of some newN-benzoyl-N′-arylureas

  摘要：

  AbstractThis paper reports the synthesis and the insecticidal activities of some N‐benzoyl‐N'‐arylureas 4‐arylsubstituted with alkylated or halogenated aroyl moieties. The compounds, tested against some representative insect species, displayed very high activity against Aedes aegypti, especially the halosubstituted derivatives. None of the newly synthesized compounds showed genotoxic activity in the Bacillus subtilis rec‐assay and in the Salmonella‐microsome test.

  DOI：

  10.1002/ps.2780450306

文献信息

• Simple and Efficient Procedure for the Friedel–Crafts Acylation of Aromatic Compounds with Carboxylic Acids in the Presence of P₂O₅/AL₂O₃Under Heterogeneous Conditions
  作者：Abdol R. Hajipour、Amin Zarei、Leila Khazdooz、Arnold E. Ruoho

  DOI：10.1080/00397910802663436

  日期：2009.7.7

  Abstract An efficient and chemoselective method for the Friedel–Crafts acylation of aromatic compounds using P2O5/Al2O3 and carboxylic acids. Both aromatic and aliphatic carboxylic acids reacted easily to afford the corresponding aromatic ketones in good yields.

  摘要 一种使用 P2O5/Al2O3 和羧酸对芳香族化合物进行 Friedel-Crafts 酰化的高效化学选择性方法。芳香族和脂肪族羧酸都容易反应，以良好的产率得到相应的芳香酮。
• Friedel–Crafts acylation of aromatic compounds with carboxylic acids in the presence of P2O5/SiO2 under heterogeneous conditions
  作者：Amin Zarei、Abdol R. Hajipour、Leila Khazdooz

  DOI：10.1016/j.tetlet.2008.09.062

  日期：2008.11

  A convenient and efficient procedure for the Friedel–Crafts acylation of aromatic compounds with carboxylic acids in the presence of P2O5/SiO2 is described. Both aromatic and aliphatic carboxylic acids reacted easily to afford the corresponding aromatic ketones. The use of non-toxic and inexpensive materials, simple and clean work-up, short reaction times and good yields of the products are the advantages

  描述了一种在P 2 O 5 / SiO 2存在下芳族化合物与羧酸的Friedel-Crafts酰化的简便有效的方法。芳族和脂族羧酸都容易反应，得到相应的芳族酮。该方法的优点是使用无毒且廉价的材料，简单且清洁的后处理，较短的反应时间和良好的产物收率。
• 4-Isopropyl-4'-nitrobenzophenone and a process for the preparation of
  申请人：Cassella Aktiengesellschaft

  公开号：US04413144A1

  公开（公告）日：1983-11-01

  4-Isopropyl-4'-nitrobenzophenone and other benzophenones of the formula ##STR1## wherein R is hydrogen, alkyl having 1 to 20 carbon atoms, alkoxy having 1 to 20 carbon atoms, alkyl having 2 to 20 carbon atoms interrupted by oxygen, or alkoxy having 2 to 20 carbon atoms interrupted by oxygen, are prepared by reacting a substituted benzene compound of the formula ##STR2## with p-nitrobenzoyl halide at temperatures of 10.degree. to 140.degree. C. in the presence of a Friedel-Crafts catalyst and an inert solvent which is an aliphatic hydrocarbon, a chlorinated aliphatic hydrocarbon or chlorinated aromatic hydrocarbon.

  4-异丙基-4'-硝基苯基酮和其他式为##STR1##其中R为氢、具有1至20个碳原子的烷基、具有1至20个碳原子的烷氧基、由氧断开的具有2至20个碳原子的烷基或由氧断开的具有2至20个碳原子的烷氧基的苯并酮，通过在存在弗里德尔-克拉夫茨催化剂和惰性溶剂的条件下，在10℃至140℃的温度下使用对硝基苯甲酰卤进行反应制备，其中惰性溶剂为脂肪烃、氯代脂肪烃或氯代芳香烃。
• Anti-Viral Compounds
  申请人：DeGoey David A.

  公开号：US20120115918A1

  公开（公告）日：2012-05-10

  Compounds effective in inhibiting replication of Hepatitis C virus (“HCV”) are described. This invention also relates to processes of making such compounds, compositions comprising such compounds, and methods of using such compounds to treat HCV infection.

  本文描述了抑制丙型肝炎病毒（“HCV”）复制的有效化合物。本发明还涉及制备此类化合物的过程，包含此类化合物的组合物以及使用此类化合物治疗HCV感染的方法。
• ANTI-VIRAL COMPOUNDS
  申请人：ABBVIE INC.

  公开号：US20140155382A1

  公开（公告）日：2014-06-05

  Compounds effective in inhibiting replication of Hepatitis C virus (“HCV”) are described. This invention also relates to processes of making such compounds, compositions comprising such compounds, and methods of using such compounds to treat HCV infection.

  本发明描述了一种有效抑制丙型肝炎病毒（“HCV”）复制的化合物。本发明还涉及制备这些化合物的过程，包含这些化合物的组合物，以及使用这些化合物治疗HCV感染的方法。