3-(1,2,2-三氯乙烯)苯胺 | 704-22-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 3-(1,2,2-三氯乙烯)苯胺
• 英文名称: 3-(trichlorovinyl)aniline
• 英文别名: 2-(3-aminophenyl)-1,1,2-trichloroethylene；Benzenamine, 3-(trichloroethenyl)-；3-(1,2,2-trichloroethenyl)aniline
• CAS: 704-22-3
• 化学式: C₈H₆Cl₃N
• 分子量: 222.501
• InChiKey: FCLZQAKBHZCBDZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  3-(1,2,2-三氯乙烯)苯胺 在 氯磺酸 、 ammonium hydroxide 、 氯化亚砜 作用下， 以 二氯甲烷 为溶剂， 反应 4.0h， 生成 克洛索隆
  参考文献：
  名称：

  一种氯舒隆的合成方法

  摘要：

  本发明提供一种氯舒隆的合成方法，所述方法以间硝基苯甲醛和三氯甲烷为初始原料，依次经缩合反应、氯代反应、消去反应、还原反应、氯磺化反应、胺化反应制得氯舒隆；其中，所述还原反应在含有盐酸、铁粉和硅藻土的体系中进行。本发明方法所获得的产品质量稳定，收率高，并且工艺相对简单，可操作性强，安全系数高，具备良好的工业化前景。

  公开号：

  CN113773235B
• 作为产物：
  描述：

  α-(trichloromethyl)-3-nitrobenzyl alcohol 在 盐酸 、 五氯化磷 、 铁粉 、 sodium hydroxide 作用下， 以 甲醇 、 乙醇 、 二氯甲烷 、 水 为溶剂， 反应 3.0h， 生成 3-(1,2,2-三氯乙烯)苯胺
  参考文献：
  名称：

  一种氯舒隆的合成方法

  摘要：

  本发明提供一种氯舒隆的合成方法，所述方法以间硝基苯甲醛和三氯甲烷为初始原料，依次经缩合反应、氯代反应、消去反应、还原反应、氯磺化反应、胺化反应制得氯舒隆；其中，所述还原反应在含有盐酸、铁粉和硅藻土的体系中进行。本发明方法所获得的产品质量稳定，收率高，并且工艺相对简单，可操作性强，安全系数高，具备良好的工业化前景。

  公开号：

  CN113773235B

文献信息

• Halogenated unsaturated alkyl benzenedisulfonamides as anthelmintics
  申请人：Merck & Co., Inc.

  公开号：US04064239A1

  公开（公告）日：1977-12-20

  Novel substituted benzenedisulfonamides are disclosed which compounds are active anthelmintic agents being particularly useful against fascioliasis in sheep and cattle. Specifically the active compounds are 4-amino-1,3-benzenedisulfonamide with an unsaturated substituted alkyl group. Compositions and methods containing the novel substituted benzenedisulfonamides for use in anthelmintic therapy particularly against liver fluke are also disclosed.

  揭示了一种新型替代苯二磺酰胺，这些化合物是活性驱虫剂，特别对羊和牛的肝吸虫病具有很好的效果。具体来说，活性化合物是带有不饱和取代烷基基团的4-氨基-1,3-苯二磺酰胺。还揭示了含有这种新型替代苯二磺酰胺的组合物和方法，用于驱虫疗法，特别是对抗肝吸虫。
• 4-Amino-6-(trichloroethenyl)-1,3-benzenedisulfonamide, a new, potent fasciolicide
  作者：Helmut Mrozik、Richard J. Bochis、Philip Eskola、Alexander Matzuk、Frank S. Waksmunski、Leonard E. Olen、George Schwartzkopf、Alex Grodski、Bruce O. Linn

  DOI：10.1021/jm00219a025

  日期：1977.9

  The synthesis and fasciolicidal activity of 4-amino-6-(trichloroethenyl)-1,3-benzenedisulfonamide are reported. A single dose of 15 mg/kg was effective in removing over 90% of immature Fasciola hepatica from sheep (6 weeks after infection) and calves (8 weeks after infection). A 2.5 mg/kg dose removed over 90% of mature (16 weeks old) liver fluke from sheep. Single oral doses up to 400 mg/kg were tolerated by sheep without gross toxic symptoms.
• Synthesis, Properties, and Pharmacokinetic Studies of N2-Phenylguanine Derivatives as Inhibitors of Herpes Simplex Virus Thymidine Kinases
  作者：Hongyan Xu、Giovanni Maga、Federico Focher、Emil R. Smith、Silvio Spadari、Joseph Gambino、George E. Wright

  DOI：10.1021/jm00001a010

  日期：1995.1

  Two series of selective inhibitors of herpes simplex virus types 1 and 2 (HSV1,2) thymidine kinases (TK) have been developed as potential treatment of recurrent virus infections. Among compounds related to the potent base analog N-2-[m-(trifluoromethyl)phenyl]guanine (mCF(3)PG), none was a more potent inhibitor than mCF(3)PG itself. Compounds related to the nucleoside N-2-phenyl-2'-deoxyguanosine (PhdG), but with alkyl, hydroxyalkyl, and related substituents at the 9-position in place of the glycosyl group of PhdG, retained significant but variable inhibitory potencies against the HSV TKs. The most potent inhibitor of HSV1 TK among 9-substituted derivatives, 9-(4-hydroxybutyl)-N-2-phenylguanine (HBPG), was a competitive inhibitor with respect to the substrate thymidine but was not itself a substrate for the enzyme. Water solubilities and 1-octanol:water partition coefficients for the 9-substituted N-2-phenylguanines were linearly but oppositely related to the sum of hydrophobic fragmental constants (Sigma f) of the 9-substituents. Four of the inhibitors were given as solutions to mice by iv and ip routes, and the time course of their plasma concentrations was determined by HPLC analysis of the parent compounds. HBPG was completely absorbed by the ip route, and the plasma concentration could be prolonged by use of suspension formulations. HBPG is a candidate for animal trials of the ability of TK inhibitors to prevent recurrent herpes virus infections.
• US2351247
  申请人：——

  公开号：——

  公开（公告）日：——
• US4064239A
  申请人：——

  公开号：US4064239A

  公开（公告）日：1977-12-20