4-[1-[3-[(4-Methoxy-3-phenylmethoxyphenyl)methoxy]phenyl]ethoxy]-3-methylbenzaldehyde | 670275-14-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-[1-[3-[(4-Methoxy-3-phenylmethoxyphenyl)methoxy]phenyl]ethoxy]-3-methylbenzaldehyde
• CAS: 670275-14-6
• 化学式: C₃₁H₃₀O₅
• 分子量: 482.576
• InChiKey: XSGHUAHJLSFEOI-UHFFFAOYSA-N

物化性质

• 沸点：
  638.6±55.0 °C(Predicted)
• 密度：
  1.169±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  36
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  4-[1-[3-[(4-Methoxy-3-phenylmethoxyphenyl)methoxy]phenyl]ethoxy]-3-methylbenzaldehyde 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 生成 [4-[1-[3-[(4-Methoxy-3-phenylmethoxyphenyl)methoxy]phenyl]ethoxy]-3-methylphenyl]methanol
  参考文献：
  名称：

  Synthesis of Ether Oligomers

  摘要：

  Hydroxyaromatic aldehydes and ketones were used as building blocks to prepare ether oligomers. An iterative two-step protocol involving Mitsunobu coupling and carbonyl reduction provided a protecting-group-free route with high yields. Activity screening of an 84-member library against proteases led to the discovery of micromolar inhibitors for trypsin, chymotrypsin, and subtilisin.

  DOI：

  10.1021/ol036300d
• 作为产物：
  描述：

  3-苄氧基-4-甲氧苄醇 在 sodium tetrahydroborate 、 偶氮二甲酸二异丙酯 、 三苯基膦 作用下， 以 四氢呋喃 、 甲醇 为溶剂， 生成 4-[1-[3-[(4-Methoxy-3-phenylmethoxyphenyl)methoxy]phenyl]ethoxy]-3-methylbenzaldehyde
  参考文献：
  名称：

  Synthesis of Ether Oligomers

  摘要：

  Hydroxyaromatic aldehydes and ketones were used as building blocks to prepare ether oligomers. An iterative two-step protocol involving Mitsunobu coupling and carbonyl reduction provided a protecting-group-free route with high yields. Activity screening of an 84-member library against proteases led to the discovery of micromolar inhibitors for trypsin, chymotrypsin, and subtilisin.

  DOI：

  10.1021/ol036300d

文献信息

• Synthesis of Ether Oligomers
  作者：Olivier Renaudet、Jean-Louis Reymond

  DOI：10.1021/ol036300d

  日期：2004.2.1

  Hydroxyaromatic aldehydes and ketones were used as building blocks to prepare ether oligomers. An iterative two-step protocol involving Mitsunobu coupling and carbonyl reduction provided a protecting-group-free route with high yields. Activity screening of an 84-member library against proteases led to the discovery of micromolar inhibitors for trypsin, chymotrypsin, and subtilisin.