2-thiocyanato-N-p-tolyl-acetamide | 10151-96-9

• 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: 2-thiocyanato-N-p-tolyl-acetamide
• 英文别名: thiocyanato-acetic acid p-toluidide；Thiocyanato-essigsaeure-p-toluidid；Rhodanessigsaeure-p-toluidid；α-thiocyanoacetic acid-p-toluidide；α-Thiocyanatoessigsaeure-p-toluidid；[2-(4-Methylanilino)-2-oxoethyl] thiocyanate
• CAS: 10151-96-9
• 化学式: C₁₀H₁₀N₂OS
• 分子量: 206.268
• InChiKey: BZWGXPNBGWWBTM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  78.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-thiocyanato-N-p-tolyl-acetamide 生成 2-imino-3-(4-methylphenyl)-4-thiazolidinone
  参考文献：
  名称：

  Wheeler; Johnson, American Chemical Journal, 1902, vol. 28, p. 124

  摘要：

  DOI：
• 作为产物：
  描述：

  potassium thioacyanate 、 2-氯-N-(4-甲基苯基)乙酰胺 在 乙醇 作用下， 生成 2-thiocyanato-N-p-tolyl-acetamide
  参考文献：
  名称：

  Wheeler; Johnson, American Chemical Journal, 1902, vol. 28, p. 124

  摘要：

  DOI：

文献信息

• A convenient, rapid, and general synthesis of α-oxo thiocyanates using clay supported ammonium thiocyanate
  作者：H.M. Meshram、Pramod B. Thakur、B. Madhu Babu、Vikas M. Bangade

  DOI：10.1016/j.tetlet.2012.01.113

  日期：2012.4

  A very rapid, convenient, and general method for the synthesis of alpha-oxo thiocyanates has been described by using clay supported ammonium thiocyanate. The procedure avoids the use of additional catalyst, solvent, aqueous work-up and the yields are high. Moreover, the method is applicable for a variety of aryl, heteroaryl, alkyl alpha-halo carbonyls, beta-keto tosylates, alpha-halo beta-dicarbonyl, alpha-tosyl, beta-dicarbonyl, alkyl halide, and alkyl tosylates. (C) 2012 Elsevier Ltd. All rights reserved.
• Acyl-isothiocyanates as Efficient Thiocyanate Transfer Reagents
  作者：Charuta C. Palsuledesai、Siva Murru、Santosh K. Sahoo、Bhisma K. Patel

  DOI：10.1021/ol901561j

  日期：2009.8.6

  An unprecedented transfer of a thiocyanate (-SCN) group from aroyl/acyl isothlocyanate to alkyl or benzylic bromide is observed in the presence of a tertiary amine. This process is most effective when the bromomethyl proton is less acidic, while the presence of a more acidic proton gives 1,3-oxathiol-2-ylidine and other related products.
• US3939184A
  申请人：——

  公开号：US3939184A

  公开（公告）日：1976-02-17
• Wheeler; Johnson, American Chemical Journal, 1902, vol. 28, p. 124
  作者：Wheeler、Johnson

  DOI：——

  日期：——