2-amino-[3-11C]isobutyric acid | 149181-76-0

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 2-amino-[3-11C]isobutyric acid
• 英文别名: [3-11C]AIB；[11C]-Alpha-Aminoisobutyric Acid；2-amino-2-methyl(311C)propanoic acid
• CAS: 149181-76-0
• 化学式: C₄H₉NO₂
• 分子量: 102.11
• InChiKey: FUOOLUPWFVMBKG-BJUDXGSMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.8
• 重原子数：
  7
• 可旋转键数：
  1
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  63.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  tert-butyl 2-((diphenylmethylene)amino)-2-methylpropanoate-3-11C 在 盐酸 作用下， 以 水 为溶剂， 反应 0.05h， 生成 2-amino-[3-11C]isobutyric acid
  参考文献：
  名称：

  An efficient and expedient method for the synthesis of 11C-labeled α-aminoisobutyric acid: A tumor imaging agent potentially useful for cancer diagnosis

  摘要：

  We describe the synthesis of C-11-labeled alpha-aminoisobutyric acid 2 from iodo[C-11] methane and methyl N-(diphenylmethylen)-D,L-alaniate (5). The tetrabutylammonium fluoride (TBAF)-promoted alpha-[C-11] methylation of sterically hindered analog 5 was a key step in our synthesis process. Total radiochemical conversion of 2 was high and a remote-controlled synthesis was carried out. A comparative tumor positron emission tomography (PET) imaging study using the same model mouse showed higher uptake of 2 than with C-11-labeled methionine and [F-18] fluorodeoxyglucose (FDG). (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.02.065

文献信息

• An efficient and expedient method for the synthesis of 11C-labeled α-aminoisobutyric acid: A tumor imaging agent potentially useful for cancer diagnosis
  作者：Koichi Kato、Atsushi B. Tsuji、Tsuneo Saga、Ming-Rong Zhang

  DOI：10.1016/j.bmcl.2011.02.065

  日期：2011.4

  We describe the synthesis of C-11-labeled alpha-aminoisobutyric acid 2 from iodo[C-11] methane and methyl N-(diphenylmethylen)-D,L-alaniate (5). The tetrabutylammonium fluoride (TBAF)-promoted alpha-[C-11] methylation of sterically hindered analog 5 was a key step in our synthesis process. Total radiochemical conversion of 2 was high and a remote-controlled synthesis was carried out. A comparative tumor positron emission tomography (PET) imaging study using the same model mouse showed higher uptake of 2 than with C-11-labeled methionine and [F-18] fluorodeoxyglucose (FDG). (C) 2011 Elsevier Ltd. All rights reserved.