[1,3]dithiolan-2-ylidenephenylamine | 705-65-7

• 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: [1,3]dithiolan-2-ylidenephenylamine
• 英文别名: 2-(phenylimino)-1,3-dithiolane；2-Phenylimino-1,3-dithiolane；[1,3]dithiolan-2-ylidene-phenyl-amine；2-Phenylimino-<1.3>-dithiolan；2-Phenylimino-1.3-dithiolane；N-phenyl-1,3-dithiolan-2-imine
• CAS: 705-65-7
• 化学式: C₉H₉NS₂
• 分子量: 195.309
• InChiKey: NIHKXHCRGWYVLM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  12
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  63
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  [1,3]dithiolan-2-ylidenephenylamine 在 镍 作用下， 以 乙醇 、 xylene 、 苯 为溶剂， 反应 30.0h， 生成 1-(4,5-bis-methoxycarbonyl-3-phenyl-2,3-dihydro-thiazol-2-yl)-buta-1,3-diene-1,2,3,4-tetracarboxylic acid tetramethyl ester
  参考文献：
  名称：

  Gueden,C.; Vialle,J., Bulletin de la Societe Chimique de France, 1973, p. 270 - 277

  摘要：

  DOI：
• 作为产物：
  描述：

  1,3-Dithiolan-2-yltriphenylphosphonium fluoroborate 、 亚硝基苯 在 正丁基锂 作用下， 生成 [1,3]dithiolan-2-ylidenephenylamine
  参考文献：
  名称：

  Preparation of a Phosphorus Ylid from 1,3-Dithiolan-2-yltriphenylphosphonium Fluoroborate and its Application to KeteneS,S-Acetal Synthesis

  摘要：

  DOI：

  10.1055/s-1981-29333

文献信息

• The Preparation of Cyclic Dithia and Thiaza Compounds by the Reaction of Potassium Carbonate with Heterocumulenes and Alkylene Dibromides or Carbonate Catalyzed by Organostannyl Compounds
  作者：Tatsuo Fujinami、Shinichi Sato、Norimasa Uchida、Shizuyoshi Sakai

  DOI：10.1246/bcsj.55.1174

  日期：1982.4

  3-dithia- and 1,3-thiaza-2-ylidene compounds were obtained by the heterogeneous reaction of solid potassium carbonate, a sulfur-containing heterocumulene, such as aryl isothiocyanate, carbon disulfide, or carbonyl sulfide, and alkylene dibromides or ethylene carbonate in the presence of bis(tributylstannyl) compounds. The effect of an organostannyl catalyst on these reactions is discussed.

  环状 1,3-二硫杂和 1,3-噻唑-2-亚基化合物是通过固体碳酸钾、含硫杂枯烯如异硫氰酸芳基酯、二硫化碳或羰基硫与二溴化烷的多相反应获得的或在双（三丁基甲锡烷基）化合物存在下的碳酸亚乙酯。讨论了有机锡烷基催化剂对这些反应的影响。
• DBU and DBU-Derived Ionic Liquid Synergistic Catalysts for the Conversion of Carbon Dioxide/Carbon Disulfide to 3-Aryl-2-oxazolidinones/[1,3]Dithiolan-2-ylidenephenyl- amine
  作者：Binshen Wang、Zhoujie Luo、Elnazeer H. M. Elageed、Shi Wu、Yongya Zhang、Xiaopei Wu、Fei Xia、Guirong Zhang、Guohua Gao

  DOI：10.1002/cctc.201500928

  日期：2016.2

  the reaction effectively. Based on these results, a possible reaction mechanism on the synergistic catalysis of DBU and the ionic liquid is proposed. In addition, the reaction of CS2, ethylene oxide, and aniline catalyzed by the combination of DBU and the DBU‐derived ionic liquid also proceeds smoothly, which opens a hitherto unreported route to [1,3]dithiolan‐2‐ylidenephenylamine in a straightforward

  已开发出1,8-二氮杂双环[5.4.0]十一碳-7-烯（DBU）和DBU衍生的溴化物离子液体的分子间协同催化组合，用于在金属和金属条件下转化CO 2，环氧化物和胺。无溶剂条件。在短时间内，以中等至极好的收率生产出各种3-芳基-2-恶唑烷酮。NMR光谱和DFT计算表明，DBU作为氢键受体，离子液体作为氢键供体，通过诱导氢键有效地促进反应，从而共同激活底物。基于这些结果，提出了DBU与离子液体协同催化的可能反应机理。此外，CS 2的反应，通过DBU和DBU衍生的离子液体的组合催化的环氧乙烷和苯胺也能顺利进行，这开辟了迄今未报道的直接通往[1,3] dithiolan-2-ylphenylenephenylamine的途径。
• 4-(Substituted alkyl)-N-(1,3-dithiolan-2-ylidene) aniline
  申请人：MERRELL DOW PHARMACEUTICALS INC.

  公开号：EP0092120A1

  公开（公告）日：1983-10-26

  N-(1,3-dithiolan-2-ylidene)-4-alkylanilines having a hydroxy, alkoxy or alkanoyloxy substituent on the alkyl group are useful as anti-inflammatory agents, as analgesic agents and as antiasthmatic agents. The compounds involved can be prepared by the reaction of an appropriate 4-alkylaniline with a methyl(1,3-dithiolan-2-ylidene)sulfonium salt or with carbon disulfide and ethylene dibromide in the presence of a base.

  烷基上具有羟基、烷氧基或烷酰氧基取代基的 N-(1,3-二硫环戊烷-2-亚基)-4-烷基苯胺可用作消炎药、镇痛药和抗哮喘药。 在碱存在下，通过适当的 4-烷基苯胺与甲基(1,3-二硫环戊烷-2-亚基)锍盐或二硫化碳和二溴化乙锭反应，可制备相关化合物。
• Dithiadiazafulvalenes-New Strong Electron Donors. Synthesis, Isolation, Properties, and EPR Studies
  作者：Gregory V. Tormos、Martin G. Bakker、Ping Wang、M. V. Lakshmikantham、Michael P. Cava、Robert M. Metzger

  DOI：10.1021/ja00138a006

  日期：1995.8

  Several dithiadiazafulvalenes, which are potent electron donors, were isolated as pure compounds for the first time. Solid charge-transfer complexes with TCNQ and also cation-radical and dication salts with perchlorate gegenions were obtained. Two of the TCNQ complexes are moderately conductive at room temperature (0.083 and 0.011 S/cm). A solution EPR study, combined with theoretical calculations, allowed the determination of the relative equilibrium cation-radical and anion-radical concentrations.
• Etlis,V.S. et al., Journal of general chemistry of the USSR, 1964, vol. 34, p. 4076 - 4079
  作者：Etlis,V.S. et al.

  DOI：——

  日期：——