| 1585185-79-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• CAS: 1585185-79-0
• 化学式: C₁₉H₁₈INO₂S
• 分子量: 451.328
• InChiKey: KNHLZAIPVNQBAL-NBVRZTHBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  24
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  45.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  在 bis-triphenylphosphine-palladium(II) chloride 、 三乙胺 作用下， 以 甲醇 为溶剂， 反应 10.0h， 以85%的产率得到2-Methoxy-3-methylidene-1-(4-methylphenyl)sulfonyl-5-phenyl-2,6-dihydropyridine
  参考文献：
  名称：

  Palladium-catalyzed cyclization of vinyl iodide-tethered allensulfonamide

  摘要：

  This Letter describes a palladium-catalyzed cyclization of vinyl iodide-tethered allensulfonamide in the presence of alkylol, which provides a facile access to 2-alkoxy-3-methylene-tetrahydropyridine. The asymmetric version of this reaction has also been preliminarily realized with up to 81% enantioselectivity when chiral bisphosphine ligands were used. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.02.087
• 作为产物：
  描述：

  (Z)-N-(3-iodo-2-phenylallyl)-4-methyl-N-(prop-2-yn-1-yl)benzenesulfonamide 在 potassium tert-butylate 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Palladium-catalyzed cyclization of vinyl iodide-tethered allensulfonamide

  摘要：

  This Letter describes a palladium-catalyzed cyclization of vinyl iodide-tethered allensulfonamide in the presence of alkylol, which provides a facile access to 2-alkoxy-3-methylene-tetrahydropyridine. The asymmetric version of this reaction has also been preliminarily realized with up to 81% enantioselectivity when chiral bisphosphine ligands were used. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.02.087

文献信息

• An organocatalytic method for constructing pyrroles <i>via</i> the cycloisomerisation of <i>Z</i>-1-iodo-4-<i>N</i>-methylbenzenesulfonyl-1,6-enynes
  作者：Long Meng、Xiaochen Chi、Xi Sun、Chengqiang Cao、Bing Ai、Qing Liu、Pingping Zhao、Zengdian Zhao、Yunhui Dong、Hui Liu

  DOI：10.1039/c9ob01123d

  日期：——

  A new cycloisomerisation of Z-1-iodo-4-N-methylbenzenesulfonyl-1,6-enynes to functionalized pyrroles was realized in the presence of an organomolecule (4,4′-bis(1,1-dimethylethyl)-2,2′-bipyridine) and KOtBu.

  在有机分子（4,4'-双(1,1-二甲基乙基)-2,2'-联吡啶）和KOtBu存在下，将Z-1-碘-4-N-甲基苯磺酰-1,6-二炔烃进行环异构化，得到官能化吡咯。