6-acetyl-7-hydroxy-2,2,5-trimethyl-2H-1-benzopyran | 93578-15-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: 6-acetyl-7-hydroxy-2,2,5-trimethyl-2H-1-benzopyran
• 英文别名: 1-(7-Hydroxy-2,2,5-trimethylchromen-6-yl)ethanone
• CAS: 93578-15-5
• 化学式: C₁₄H₁₆O₃
• 分子量: 232.279
• InChiKey: LYYRTLNEPIBLAE-UHFFFAOYSA-N

物化性质

• 熔点：
  78-80 °C
• 沸点：
  383.8±42.0 °C(Predicted)
• 密度：
  1.131±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  6-acetyl-3,4-dihydro-7-hydroxy-2,2,5-trimethyl-2H-1-benzopyran 在 2,3-二氯-5,6-二氰基-1,4-苯醌 作用下， 以 苯 为溶剂， 反应 10.0h， 以0.10 g的产率得到6-acetyl-7-hydroxy-2,2,5-trimethyl-2H-1-benzopyran
  参考文献：
  名称：

  Ahluwalia, V. K.; Mukherjee, Keya, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1984, vol. 23, # 9, p. 880 - 882

  摘要：

  DOI：

文献信息

• Anti-AIDS agents 83. Efficient microwave-assisted one-pot preparation of angular 2,2-dimethyl-2H-chromone containing compounds
  作者：Ting Zhou、Qian Shi、Kuo Hsing Lee

  DOI：10.1016/j.tetlet.2010.06.058

  日期：2010.8

  A novel and efficient microwave-assisted one-pot reaction was developed to synthesize angular 2,2-dimethyl-2H-chromone-containing compounds, which is the first and key step in the synthesis of potent DCK and DCP anti-HIV agents The newly developed microwave synthesis conditions dramatically shortened the reaction time from 2 clays to 4 h with improved yields (c) 2010 Elsevier Ltd All rights reserved
• AHLUWALIA, V. K.;MUKHERJEE, KEYA, INDIAN J. CHEM., 1984, 23, N 9, 880-882
  作者：AHLUWALIA, V. K.、MUKHERJEE, KEYA

  DOI：——

  日期：——
• Ahluwalia, V. K.; Mukherjee, Keya, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1984, vol. 23, # 9, p. 880 - 882
  作者：Ahluwalia, V. K.、Mukherjee, Keya

  DOI：——

  日期：——