3,6-bis(4-methoxyphenyl)-9-phenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione | 59586-53-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 3,6-bis(4-methoxyphenyl)-9-phenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
• 英文别名: 3,6-bis(4-methoxyphenyl)-9-phenyl-3,4,5,6,7,9-hexahydro-2H-xanthene-1,8-dione
• CAS: 59586-53-7
• 化学式: C₃₃H₃₀O₅
• mdl: MFCD07469495
• 分子量: 506.598
• InChiKey: MVURFWVERIYHRR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  38
• 可旋转键数：
  5
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  61.8
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  5-[4-(甲氧苯基)]-1,3-环己二酮 、 苯甲醛 在 硫酸 作用下， 以 水 为溶剂， 反应 2.0h， 以88%的产率得到3,6-bis(4-methoxyphenyl)-9-phenyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
  参考文献：
  名称：

  Green Synthesis of 1,8-Dioxo-octahydroxanthene Derivatives Using Catalytic Amount of H₂SO₄in Water

  摘要：

  An green and convenient approach to the synthesis of 3,6,9-aryl-1,8-dioxo-1,2,3,4,5,6,7,8-octahydroxanthene derivatives from appropriate aromatic aldehydes and 5-aryl-1,3-cyclo-hexanedione in the presence of two drops of concentrated H2SO4 as a catalyst in water is described. This method provides several advantages such as environmental friendliness, low cost, excellent yields, and simple workup procedure.

  DOI：

  10.1080/00397910903162825

文献信息

• LEMBA YA. K.; BLUMS EH. V.; LIELBRIEDIS I. EH., IZV. AN LATVSSR. CEP. XIM. <LZAK-AM>, 1976, HO 2, 207-210
  作者：LEMBA YA. K.、 BLUMS EH. V.、 LIELBRIEDIS I. EH.

  DOI：——

  日期：——
• Green Synthesis of 1,8-Dioxo-octahydroxanthene Derivatives Using Catalytic Amount of H₂SO₄in Water
  作者：Rui-Hua Wang、Bin Cui、Wen-Tao Zhang、Guang-Fan Han

  DOI：10.1080/00397910903162825

  日期：2010.5.19

  An green and convenient approach to the synthesis of 3,6,9-aryl-1,8-dioxo-1,2,3,4,5,6,7,8-octahydroxanthene derivatives from appropriate aromatic aldehydes and 5-aryl-1,3-cyclo-hexanedione in the presence of two drops of concentrated H2SO4 as a catalyst in water is described. This method provides several advantages such as environmental friendliness, low cost, excellent yields, and simple workup procedure.