4-chloro-2-phenoxy-1,3-thiazole-5-carbaldehyde | 1000932-30-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-chloro-2-phenoxy-1,3-thiazole-5-carbaldehyde
• CAS: 1000932-30-8
• 化学式: C₁₀H₆ClNO₂S
• mdl: MFCD09863360
• 分子量: 239.682
• InChiKey: MWDMJNZOVXEWSU-UHFFFAOYSA-N

物化性质

• 熔点：
  50 °C(Solv: hexane (110-54-3))
• 沸点：
  376.2±45.0 °C(Predicted)
• 密度：
  1.440±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  67.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2,4-二氯噻唑-5-甲醛 、 苯酚 在 potassium carbonate 作用下， 以 乙腈 为溶剂， 反应 16.0h， 以70%的产率得到4-chloro-2-phenoxy-1,3-thiazole-5-carbaldehyde
  参考文献：
  名称：

  Thiazole analogs of chalcones, capable of functionalization at the heterocyclic nucleus

  摘要：

  The synthesis of new amino and alkoxy derivatives of thiazole-5-carbaldehyde, on the basis of which alpha,beta-unsaturated ketones of the thiazole series were synthesized, are described in this paper. The possibility of obtaining chalcones and variation of substitution reactions in the thiazole ring has been shown.

  DOI：

  10.1007/s10593-010-0509-y

文献信息

• Thiazole analogs of chalcones, capable of functionalization at the heterocyclic nucleus
  作者：V. N. Kotlyar、P. A. Pushkarev、V. D. Orlov、V. N. Chernenko、S. M. Desenko

  DOI：10.1007/s10593-010-0509-y

  日期：2010.7

  The synthesis of new amino and alkoxy derivatives of thiazole-5-carbaldehyde, on the basis of which alpha,beta-unsaturated ketones of the thiazole series were synthesized, are described in this paper. The possibility of obtaining chalcones and variation of substitution reactions in the thiazole ring has been shown.