(R)-α-hydroxy-α-(4-aminophenyl)-α-phenylacetic acid | 137820-94-1

• 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: (R)-α-hydroxy-α-(4-aminophenyl)-α-phenylacetic acid
• 英文别名: (R)-4-aminobenzilic acid；(2R)-2-(4-aminophenyl)-2-hydroxy-2-phenylacetic acid
• CAS: 137820-94-1
• 化学式: C₁₄H₁₃NO₃
• 分子量: 243.262
• InChiKey: JVAWZNLRUYSIMO-CQSZACIVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  83.6
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (R)-α-hydroxy-α-(4-aminophenyl)-α-phenylacetic acid 在 盐酸 、 potassium iodide 、 sodium nitrite 作用下， 生成 (R)-α-hydroxy-α-(4-iodophenyl)benzeneacetate
  参考文献：
  名称：

  Synthesis of the four stereoisomers of 1-azabicyclo[2.2.2]oct-3-yl-α-hydroxy-α-(4-phenylboronic acid)-α-phenylacetate (QNB-boronic acid), including a preparative HPLC method to separate diastereoisomeric mixtures with high optical purity

  摘要：

  The four stereoisomers of 1-azabicyclo[2.2.2]oct-3-yl-alpha-hydroxy-alpha-(4-phenylboronic acid)-alpha-phenylacetate (QNB boronic acids, 1a-1d) were synthesized initially via 1-azabicyclo[2.2.2]oct-3-yl-alpha hydroxy-alpha-(4-iodophenyl)-alpha-phenylacetate (iodo-QNBs, 6a-6d) using an adaptation of a published procedure. The number of steps involved were reduced substantially using a distinctly different approach. This involved the synthesis of diastereoisomers of QNB-boronic acid, followed by separation and isolation of enantiomers by preparative reversed-phase HPLC. An improved method of synthesis of alpha-hydroxy-alpha-(4-aminophenyl)-alpha-phenyl-acetic acid (3a and 3b) from alpha-hydroxy-alpha-(4-nitrophenyl)-alpha-phenylacetic acid (2a and 2b) is also described.

  DOI：

  10.1016/s0957-4166(00)82085-6
• 作为产物：
  描述：

  (R)-α-hydroxy-α-(4-nitrophenyl)-α-phenylacetic acid 在 肼 作用下， 以 乙醇 为溶剂， 以82%的产率得到(R)-α-hydroxy-α-(4-aminophenyl)-α-phenylacetic acid
  参考文献：
  名称：

  Boronic acid adducts of rhenium dioxime and technetium-99m dioxime

  摘要：

  硼酸添加物和放射性重铼二氧化物络合物的锝-99m，每种均包含生化活性基团，分别用作诊断和治疗剂。

  公开号：

  US05387409A1

文献信息

• Boronic acid adducts of rhenium dioxime and technetium-99M dioxime complexes containing a biochemically active group
  申请人：BRACCO INTERNATIONAL B.V.

  公开号：EP0441491A1

  公开（公告）日：1991-08-14

  Boronic acid adducts of technetium-99m and radioactive rhenium dioxime complexes, each of which include biochemically active groups, are useful as diagnostic and therapeutic agents, respectively.

  锝-99m 的硼酸加合物和放射性二氧化铼络合物都含有生化活性基团，可分别用作诊断和治疗药物。
• US5387409A
  申请人：——

  公开号：US5387409A

  公开（公告）日：1995-02-07