(2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl)methanol

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: (2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl)methanol
• 英文别名: Pzcaklonrpgugk-uhfffaoysa-；[2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl]methanol
• 化学式: C₁₃H₁₈O₄
• 分子量: 238.284
• InChiKey: PZCAKLONRPGUGK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  47.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl)methanol 、 alkaline earth salt of/the/ methylsulfuric acid 生成 Tert-butyl-[[2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane
  参考文献：
  名称：

  Synthesis and structure of 2-aryl-5,5-disubstituted-1,3-dioxanes and conversion into chiral (1,1,1-trishydroxymethyl) methane derivatives

  摘要：

  Pentaerythritol, (1,1,1-trishydroxymethyl)methyl methane and ( 1, 1,1-trishydroxymethyl)nitro methane are converted into 2-aryl-5.5-bis(hydroxymethyl), 2-aryl-5-hydroxymethyl-5-methyl- or 2-aryl-5-hydroxymethyl-5-nitro-1,3-dioxanes and a range of derivatives. X-Ray and NMR analysis establishes that the latter is obtained as a single diastereomer whose structure is unambiguously determined. These materials can be elaborated to chiral derivatives of the starting (1.1.1-trishydroxymethyl) methanes. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)00176-4
• 作为产物：
  描述：

  1,1,1-三(羟甲基)乙烷 、 4-甲氧基苯甲醛 在 camphor-10-sulfonic acid 作用下， 以 乙腈 为溶剂， 生成 (2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-5-yl)methanol
  参考文献：
  名称：

  Synthesis and structure of 2-aryl-5,5-disubstituted-1,3-dioxanes and conversion into chiral (1,1,1-trishydroxymethyl) methane derivatives

  摘要：

  Pentaerythritol, (1,1,1-trishydroxymethyl)methyl methane and ( 1, 1,1-trishydroxymethyl)nitro methane are converted into 2-aryl-5.5-bis(hydroxymethyl), 2-aryl-5-hydroxymethyl-5-methyl- or 2-aryl-5-hydroxymethyl-5-nitro-1,3-dioxanes and a range of derivatives. X-Ray and NMR analysis establishes that the latter is obtained as a single diastereomer whose structure is unambiguously determined. These materials can be elaborated to chiral derivatives of the starting (1.1.1-trishydroxymethyl) methanes. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)00176-4

文献信息

• Full and partial differentiation of tris-1,1,1-(hydroxymethyl)ethane via direct and indirect methodology
  作者：Philip Clarke、Martin J Jeffery、A.James Boydell、Sally Whiting、Bruno Linclau

  DOI：10.1016/j.tet.2004.02.056

  日期：2004.4

  Tris-1,1,1-(hydroxymethyl)ethane 1 was converted to a series of mono- and disubstituted derivatives. An indirect protocol for the differentiation of the alcohol groups was employed for the synthesis of partially and fully differentiated 1 containing a protected aldehyde unit. Complete differentiation of the alcohol groups was also achieved using a direct strategy (two steps from 1). The first synthesis of 1,3-dialclehydes derived from 1 is reported in two steps. (C) 2004 Elsevier Ltd. All rights reserved.
• Synthesis and structure of 2-aryl-5,5-disubstituted-1,3-dioxanes and conversion into chiral (1,1,1-trishydroxymethyl) methane derivatives
  作者：John M Gardiner、Paul Mather、Ramy Morjan、Robin G Pritchard、John E Warren、Malcolm L Cooper、Abd El-Rahman S Ferwanah、Omar S Abu-Tiem

  DOI：10.1016/s0040-4039(02)00176-4

  日期：2002.3

  Pentaerythritol, (1,1,1-trishydroxymethyl)methyl methane and ( 1, 1,1-trishydroxymethyl)nitro methane are converted into 2-aryl-5.5-bis(hydroxymethyl), 2-aryl-5-hydroxymethyl-5-methyl- or 2-aryl-5-hydroxymethyl-5-nitro-1,3-dioxanes and a range of derivatives. X-Ray and NMR analysis establishes that the latter is obtained as a single diastereomer whose structure is unambiguously determined. These materials can be elaborated to chiral derivatives of the starting (1.1.1-trishydroxymethyl) methanes. (C) 2002 Elsevier Science Ltd. All rights reserved.

表征谱图