7,8-ethylenedioxy-4-methyl coumarin | 35686-01-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 7,8-ethylenedioxy-4-methyl coumarin
• 英文别名: 7-methyl-2H-[1,4]dioxino [2,3-h] chromen-9(3H)one；4-Methyl-7,8-ethylendioxy-cumarin；7-Methyl-2,3-dihydropyrano[3,2-h][1,4]benzodioxin-9-one
• CAS: 35686-01-2
• 化学式: C₁₂H₁₀O₄
• 分子量: 218.209
• InChiKey: TXKOOODHKHLAFG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  44.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  7,8-ethylenedioxy-4-methyl coumarin 以 aq. buffer 为溶剂， 生成
  参考文献：
  名称：

  Electrochemical behavior of some ethylenedioxycoumarins: Cathodic dimerization

  摘要：

  Electrochemical behavior of recently synthesized 7,8-ethylenedioxy-4-methyl-2(H)-1-benzopyran-2-one, (1), 7,8-ethylenedioxy-2(H)-1-benzopyran-2-one, (2), and 6,7-ethylenedioxy-4-methy1-2(H)-1-benzopyran-2-one, (3) was studied using cyclic voltammetry at a hanging mercury drop electrode and controlled-potential coulometric techniques. The results indicated that an irreversible one-electron cathodic peak was observed for each compound in the potential range from 0.0 to -2.0 V. The coulometric experiments were performed in a low yield and the products were identified by FT-IR spectrometry, H-1 NMR and mass spectrometry. The coulometric results indicated a dimeric product for each compound. A mechanism for the electrodimerization pathway was proposed. (C) 2014 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molliq.2014.04.006
• 作为产物：
  描述：

  邻苯三酚 在 氢氧化钾 、 硫酸 作用下， 以 水 为溶剂， 反应 18.0h， 生成 7,8-ethylenedioxy-4-methyl coumarin
  参考文献：
  名称：

  Ahmed; Khan; Alam, Pharmazie, 2003, vol. 58, # 3, p. 173 - 176

  摘要：

  DOI：

文献信息

• FUJITA HARUSHIGE; YAMASHITA MASATARO, YAKUGAKU DZASSI, YAKUGAKU ZASSNI, J. PHARM. SOS. JAR. <YKKZ-AJ>, 1975, 95+
  作者：FUJITA HARUSHIGE、 YAMASHITA MASATARO

  DOI：——

  日期：——
• Ahmed; Khan; Alam, Pharmazie, 2003, vol. 58, # 3, p. 173 - 176
  作者：Ahmed、Khan、Alam

  DOI：——

  日期：——
• Electrochemical behavior of some ethylenedioxycoumarins: Cathodic dimerization
  作者：Sami Tuğral、Mustafa L. Berkem

  DOI：10.1016/j.molliq.2014.04.006

  日期：2014.8

  Electrochemical behavior of recently synthesized 7,8-ethylenedioxy-4-methyl-2(H)-1-benzopyran-2-one, (1), 7,8-ethylenedioxy-2(H)-1-benzopyran-2-one, (2), and 6,7-ethylenedioxy-4-methy1-2(H)-1-benzopyran-2-one, (3) was studied using cyclic voltammetry at a hanging mercury drop electrode and controlled-potential coulometric techniques. The results indicated that an irreversible one-electron cathodic peak was observed for each compound in the potential range from 0.0 to -2.0 V. The coulometric experiments were performed in a low yield and the products were identified by FT-IR spectrometry, H-1 NMR and mass spectrometry. The coulometric results indicated a dimeric product for each compound. A mechanism for the electrodimerization pathway was proposed. (C) 2014 Elsevier B.V. All rights reserved.