methyl 4-(2-(2,4-difluorophenyl)-2H-tetrazol-5-yl)benzoate | 1040737-51-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: methyl 4-(2-(2,4-difluorophenyl)-2H-tetrazol-5-yl)benzoate
• 英文别名: Methyl 4-[2-(2,4-difluorophenyl)tetrazol-5-yl]benzoate
• CAS: 1040737-51-6
• 化学式: C₁₅H₁₀F₂N₄O₂
• 分子量: 316.267
• InChiKey: DXLCKOJJTSEPCZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  69.9
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  methyl 4-(2-(2,4-difluorophenyl)-2H-tetrazol-5-yl)benzoate 、 丙烯酸 反应 0.02h， 生成 2-(2,4-Difluorophenyl)-5-(4-methoxycarbonylphenyl)-3,4-dihydropyrazole-3-carboxylic acid
  参考文献：
  名称：

  Rapid and sensitive detection of acrylic acid using a novel fluorescence assay

  摘要：

  开发了一种检测丙烯酸的荧光检测方法，该方法是一种基于光活化的1,3-偶极环加成反应，适用于体内外应用，并且丙烯酸是生物质生产的重要目标。

  DOI：

  10.1039/c4ra12495b

文献信息

• DETECTION OF ACRYLIC ACID
  申请人：AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH

  公开号：US20170121752A1

  公开（公告）日：2017-05-04

  There is provided a method for detecting the presence or absence of acrylic acid or its derivatives thereof in a sample, the method comprising the steps of: (a) introducing a probe comprising a diaryltetrazole compound to the sample; (b) exposing said sample to light; and (c) detecting the presence or absence of acrylic acid or its derivatives thereof in the sample based on fluorescence emitted by the sample after step (c).
• [EN] DETECTION OF ACRYLIC ACID<br/>[FR] DÉTECTION D'ACIDE ACRYLIQUE
  申请人：AGENCY SCIENCE TECH & RES

  公开号：WO2015174933A1

  公开（公告）日：2015-11-19

  There is provided a method for detecting the presence or absence of acrylic acid or its derivatives thereof in a sample, the method comprising the steps of: (a) introducing a probe comprising a diaryltetrazole compound to the sample; (b) exposing said sample to light; and (c) detecting the presence or absence of acrylic acid or its derivatives thereof in the sample based on fluorescence emitted by the sample after step (c).