1-[5-[bis(1-methylethyl)(phenylmethoxy)silyl]-2-(hydroxy)phenyl]-2-phenylethanone | 261960-69-4

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: 1-[5-[bis(1-methylethyl)(phenylmethoxy)silyl]-2-(hydroxy)phenyl]-2-phenylethanone
• 英文别名: 1-[2-Hydroxy-5-[phenylmethoxy-di(propan-2-yl)silyl]phenyl]-2-phenylethanone；1-[2-hydroxy-5-[phenylmethoxy-di(propan-2-yl)silyl]phenyl]-2-phenylethanone
• CAS: 261960-69-4
• 化学式: C₂₇H₃₂O₃Si
• 分子量: 432.635
• InChiKey: FYJWQQVBDCXTCQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.01
• 重原子数：
  31
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1-[5-[bis(1-methylethyl)(phenylmethoxy)silyl]-2-(hydroxy)phenyl]-2-phenylethanone 在 四丁基氟化铵 作用下， 以 四氢呋喃 为溶剂， 反应 6.5h， 生成 2-甲基-3-苯基色烯-4-酮
  参考文献：
  名称：

  A Novel Synthesis of 2,3-Disubstituted Benzopyran-4-ones and Application to the Solid Phase

  摘要：

  The development of a novel synthesis of 2,3-disubstituted benzopyran-4-ones and application to the solid phase are reported. Following model studies using benzyl alcohol as a surrogate for polystyrene hydroxymethyl resin, we utilized our previously established traceless diisopropyrsilyloxy Linker methodology to synthesize a small library of target benzopyranones in generally high yield and purity. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(99)01045-5
• 作为产物：
  描述：

  1-[5-[bis(1-methylethyl)(phenylmethoxy)silyl]-2-(methoxymethoxy)phenyl]-2-phenylethanol 在 草酰氯 、 二甲基亚砜 、 三乙胺 、 三氟乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 生成 1-[5-[bis(1-methylethyl)(phenylmethoxy)silyl]-2-(hydroxy)phenyl]-2-phenylethanone
  参考文献：
  名称：

  A Novel Synthesis of 2,3-Disubstituted Benzopyran-4-ones and Application to the Solid Phase

  摘要：

  The development of a novel synthesis of 2,3-disubstituted benzopyran-4-ones and application to the solid phase are reported. Following model studies using benzyl alcohol as a surrogate for polystyrene hydroxymethyl resin, we utilized our previously established traceless diisopropyrsilyloxy Linker methodology to synthesize a small library of target benzopyranones in generally high yield and purity. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(99)01045-5