N-(2-Hydroxy-propyl)-thiobenzamide | 92877-45-7

• 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: N-(2-Hydroxy-propyl)-thiobenzamide
• 英文别名: N-(2-hydroxypropyl)benzenecarbothioamide
• CAS: 92877-45-7
• 化学式: C₁₀H₁₃NOS
• 分子量: 195.285
• InChiKey: IMGLRTJOKGZMSV-UHFFFAOYSA-N

物化性质

• 沸点：
  319.4±44.0 °C(Predicted)
• 密度：
  1.158±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  64.4
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-(2-Hydroxy-propyl)-thiobenzamide 在 全氟丁基磺酰氟 、 三乙胺 作用下， 以 二氯甲烷 为溶剂， 以85%的产率得到5-甲基-2-苯基-4,5-二氢-1,3-噻唑
  参考文献：
  名称：

  Fluoroalkanosulfonyl fluorides-mediated cyclodehydration of β-hydroxy sulfonamides and β-hydroxy thioamides to the corresponding aziridines and thiazolines

  摘要：

  An efficient method for the fluoroalkanosulfonyl fluoride-induced cyclodehydration of beta-hydroxy sulfonamides and beta-hydroxy thioamides to the corresponding aziridines and thiazolines is reported. Mild reaction conditions, operational simplicity, and high yields are the major advantages of this method. (c) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.08.045
• 作为产物：
  描述：

  苯甲醛 、 异丙醇胺 在 sulfur 作用下， 以 1,4-二氧六环 为溶剂， 反应 3.0h， 以40%的产率得到N-(2-Hydroxy-propyl)-thiobenzamide
  参考文献：
  名称：

  Robbe; Fernandez; Chapat, European Journal of Medicinal Chemistry, 1985, vol. 20, # 1, p. 16 - 24

  摘要：

  DOI：

文献信息

• Sulfur-containing Heterocycles Derived by Reaction of N-Thioacylamino Alcohols with Lawesson’s Reagent and Saponification of N-Thioacylamino Esters
  作者：Takehiko Nishio、Hiroshi Sekiguchi

  DOI：10.3987/com-02-s(m)9

  日期：——

  The treatment of 2-N-thioacylamino alcohols (1) with Lawesson's reagent [LR: 2,4-bis(p-methoxyphenyl)-1,3,2,4-dithiaphosphetane 2,4-disulfide] afforded the sulfur-containing heterocycles, 1,3-thiazolines (2) in moderate to good yields, exclusively. The saponification of N-thioacylamino esters (4), which were prepared by the thionation of N-acylamino esters (3) with LR, with K2CO3 gave 3,1-benezothiazines (5) and 3,1-benzoxazines (6).
• ROBBE, Y.;FERNANDEZ, J. -P.;CHAPAT, J. -P.;SENTENAC-ROUMANOU, H.;FATOME, +, EUR. J. MED. CHEM., 1985, 20, N 1, 16-24
  作者：ROBBE, Y.、FERNANDEZ, J. -P.、CHAPAT, J. -P.、SENTENAC-ROUMANOU, H.、FATOME, +

  DOI：——

  日期：——
• Robbe; Fernandez; Chapat, European Journal of Medicinal Chemistry, 1985, vol. 20, # 1, p. 16 - 24
  作者：Robbe、Fernandez、Chapat、et al.

  DOI：——

  日期：——
• Fluoroalkanosulfonyl fluorides-mediated cyclodehydration of β-hydroxy sulfonamides and β-hydroxy thioamides to the corresponding aziridines and thiazolines
  作者：Zhaohua Yan、Chengbo Guan、Zhangxin Yu、Weisheng Tian

  DOI：10.1016/j.tetlet.2013.08.045

  日期：2013.10

  An efficient method for the fluoroalkanosulfonyl fluoride-induced cyclodehydration of beta-hydroxy sulfonamides and beta-hydroxy thioamides to the corresponding aziridines and thiazolines is reported. Mild reaction conditions, operational simplicity, and high yields are the major advantages of this method. (c) 2013 Elsevier Ltd. All rights reserved.