1H-咪唑-1-羧酸 | 68887-64-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 中文名称: 1H-咪唑-1-羧酸
• 英文名称: imidazole carboxylic acid
• 英文别名: (1H-imidazol-4-yl)carboxylic acid；1H-imidazol-1-ium-1-carboxylate
• CAS: 68887-64-9
• 化学式: C₄H₄N₂O₂
• 分子量: 112.088
• InChiKey: OKRROXQXGNEUSS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.3
• 重原子数：
  8
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  55.1
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  cobalt(II) nitrate hexahydrate 、 1H-咪唑-1-羧酸 在 NaOH 作用下， 以 水 为溶剂， 以25%的产率得到[Co(1H-imidazole-1-yl-acetate)2]n
  参考文献：
  名称：

  Metal–organic coordination architectures of azole heterocycle ligands bearing acetic acid groups: Synthesis, structure and magnetic properties

  摘要：

  Four new coordination complexes with azole heterocycle ligands bearing acetic acid groups, [Co(L-1)2](n) (1), [(CuLN3)-N-1](n) (2), [Cu(L-2)(2)center dot 0.5C(2)H(5)OH center dot H2O](n) (3) and (CO(L-2)(2)](n) (4) (here, HL1 = 1H-imidazole-1-yl-acetic acid, HL2 = 1H-benzimidazole-1-yl-acetic acid) have been synthesized and structurally characterized. Single-crystal structure analysis shows that 3 and 4 are 2D complexes with 4(4)-sql topologies, while another 2D complex 1 has a (4(3))(2)(4(6))-kgd topology. And 2 is a 3D complex composed dinuclear mu(1,1)-bridging aziclo Cu-II entities with distorted rutile topology. The magnetic properties of 1 and 2 have been studied. (C) 2009 Elsevier Inc. All rights reserved.

  DOI：

  10.1016/j.jssc.2009.07.059
• 作为产物：
  描述：

  1-乙氧甲酰咪唑 在 硫酸 作用下， 以 水 为溶剂， 反应 10.0h， 生成 1H-咪唑-1-羧酸
  参考文献：
  名称：

  一种羧基咪唑类质子型离子液体及其制备方法与应用

  摘要：

  本发明涉及润滑油添加剂领域，具体为一种铵盐羧基咪唑质子型离子液体及其制备方法与应用。本发明的离子液体为铵盐羧基咪唑质子型离子液体，结构式如式(1)所示： 本发明铵盐羧基咪唑质子型离子液体制备方法简单，且不含卤素、硫、磷等元素，不会对环境造成污染；本发明中的铵盐羧基咪唑质子型离子液体作为添加剂在复合锂基润滑脂中的减摩抗磨性能优异。

  公开号：

  CN113979946A

文献信息

• Synergism of fused bicyclic 2-aminothiazolyl compounds with polymyxin B against <i>Klebsiella pneumoniae</i>
  作者：Rong Wang、Shuang Hou、Xiaojing Dong、Daijie Chen、Lei Shao、Liujia Qian、Zhong Li、Xiaoyong Xu

  DOI：10.1039/c7md00354d

  日期：——

  A series of fused bicyclic 2-aminothiazolyl compounds were synthesized and evaluated for their synergistic effects with polymyxin B (PB) against Klebsiella pneumoniae (SIPI-KPN-1712).

  一系列融合的双环2-氨基噻唑基化合物被合成并评估其与多粘菌素B（PB）对抗肺炎克雷伯菌（SIPI-KPN-1712）的协同效应。
• 3,4-dihydro-(1H)quinazolin-2-one compounds as CSBP/p38 kinase inhibitors
  申请人：SmithKline Beecham Corporation

  公开号：US07053099B1

  公开（公告）日：2006-05-30

  Novel substituted quinazoline compounds and compositions for use in therapy as CSBP/p38 kinase inhibitors.

  小说替代喹唑啉化合物和组合物，用于治疗CSBP/p38激酶抑制剂。
• NAKANISHI, WARO;IKEDA, YOSHITSUGU;IWAMURA, HIIZU, J. ORG. CHEM., 1982, 47, N 12, 2275-2278
  作者：NAKANISHI, WARO、IKEDA, YOSHITSUGU、IWAMURA, HIIZU

  DOI：——

  日期：——
• WO2023/63317
  申请人：——

  公开号：——

  公开（公告）日：——
• Metal–organic coordination architectures of azole heterocycle ligands bearing acetic acid groups: Synthesis, structure and magnetic properties
  作者：Bo-Wen Hu、Jiong-Peng Zhao、Qian Yang、Tong-Liang Hu、Wen-Ping Du、Xian-He Bu

  DOI：10.1016/j.jssc.2009.07.059

  日期：2009.10

  Four new coordination complexes with azole heterocycle ligands bearing acetic acid groups, [Co(L-1)2](n) (1), [(CuLN3)-N-1](n) (2), [Cu(L-2)(2)center dot 0.5C(2)H(5)OH center dot H2O](n) (3) and (CO(L-2)(2)](n) (4) (here, HL1 = 1H-imidazole-1-yl-acetic acid, HL2 = 1H-benzimidazole-1-yl-acetic acid) have been synthesized and structurally characterized. Single-crystal structure analysis shows that 3 and 4 are 2D complexes with 4(4)-sql topologies, while another 2D complex 1 has a (4(3))(2)(4(6))-kgd topology. And 2 is a 3D complex composed dinuclear mu(1,1)-bridging aziclo Cu-II entities with distorted rutile topology. The magnetic properties of 1 and 2 have been studied. (C) 2009 Elsevier Inc. All rights reserved.