(benzotriazol-1-yloxy)acetic acid | 639475-09-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并三唑类
• 英文名称: (benzotriazol-1-yloxy)acetic acid
• 英文别名: 2-(Benzotriazol-1-yloxy)acetic acid
• CAS: 639475-09-5
• 化学式: C₈H₇N₃O₃
• mdl: MFCD06335053
• 分子量: 193.162
• InChiKey: PDUXROJIRWXTKQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.125
• 拓扑面积：
  77.2
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1'-(p-aminobenzyl)-17-(cyclopropylmethyl)-6,7-didehydro-4,5α-epoxy-3,14-dihydroxyindolo<2',3':6,7>morphinan 、 (benzotriazol-1-yloxy)acetic acid 以 二氯甲烷 为溶剂， 反应 3.0h， 生成 2-(benzotriazol-1-yloxy)-N-[4-[[(1S,2S,13R,21R)-22-(cyclopropylmethyl)-2,16-dihydroxy-14-oxa-11,22-diazaheptacyclo[13.9.1.01,13.02,21.04,12.05,10.019,25]pentacosa-4(12),5,7,9,15,17,19(25)-heptaen-11-yl]methyl]phenyl]acetamide
  参考文献：
  名称：

  Korlipara; Takemori; Portoghese, Journal of Medicinal Chemistry, 1995, vol. 38, # 8, p. 1337 - 1343

  摘要：

  DOI：
• 作为产物：
  描述：

  2-硝基苯肼 在 sodium hydroxide 、 三乙胺 作用下， 以 乙醇 、 xylene 为溶剂， 反应 6.0h， 生成 (benzotriazol-1-yloxy)acetic acid
  参考文献：
  名称：

  Antiinflammatory and antinociceptive activities of some benzotriazolylalkanoic acids

  摘要：

  Sets of benzotriazol-1/2-ylalkanoic acids (1, 2, 3) and benzotriazol-1-yloxyalkanoic acids (4, 5) were prepared and tested for antiinflammatory activity; when significant activity was observed also the antinociceptive activity was explored. While the acids of structure 1, 4 and 5 were devoid of antiinflammatory action, most 2-(benzotriazol-1/2-yl)propionic acids (2, 3) exhibited significant activity as antiinflammatory and antinociceptive agents, with compound 2c and 3a being the most active in the two assays, respectively. The dextrorotatory enantiomer of 2c ((+)-2c) was also prepared and found to be practically as active as the racemic mixture, though some differences in the steepness of the dose-response curves were observed.

  DOI：

  10.1016/s0014-827x(02)00003-4

文献信息

• Benzotriazol-based structure assemble directed by transition metals
  作者：Ning-Ning Ji、Zhi-Qiang Shi、Hai-Liang Hu

  DOI：10.1007/s11224-018-1194-1

  日期：2019.2

  Two coordination polymers, namely [Mn(L)2(H2O)2]n (1) and [Cd2(L)4(H2O)4]n (2) HL = (benzotriazol-1-yloxy)-acetic acid}, have been synthesized and characterized by single-crystal X-ray diffraction as well as with infrared spectroscopy and elemental analysis. The results reveal that CP1 has 1D double chain structure, while CP2 features a 1D infinite chain structure. Additionally, there both exist O–H···O

  两种配位聚合物，即[Mn(L)2(H2O)2]n(1)和[Cd2(L)4(H2O)4]n(2)HL=(苯并三唑-1-基氧基)-乙酸} , 已合成并通过单晶 X 射线衍射以及红外光谱和元素分析进行​​表征。结果表明CP1具有一维双链结构，而CP2具有一维无限链结构。此外，CP1和CP2中均存在O-H···O和O-H···N氢键，分别形成3D超分子结构。CP1 的紫外可见吸收光谱和 CP2 的光致发光特性已在室温下以固态进行了检查。2.80 eV 的光能隙结果表明 CP1 是一种潜在的半导体材料。
• [EN] NITROGEN SUBSTITUTED AROMATIC TRIAZOLES AS CORROSION CONTROL AGENTS<br/>[FR] TRIAZOLES AROMATIQUES SUBSTITUÉS PAR DE L'AZOTE EN TANT QU'AGENTS DE RÉGULATION DE CORROSION
  申请人：GEN ELECTRIC

  公开号：WO2017197047A1

  公开（公告）日：2017-11-16

  Compositions and methods for inhibiting corrosion of metallic surfaces in contact with an aqueous medium such as copper, copper alloy, and steel surfaces of an open recirculating cooling water system. In certain embodiments, an aromatic triazole having an anionic substituent bonded to a nitrogen atom of the triazole (ANST) is used as the corrosion inhibitor. In other embodiments, the corrosion inhibitor is a reaction product of an aromatic triazole and an aldehyde (ATA).

  用于抑制与水性介质接触的金属表面腐蚀的组合物和方法，例如开放循环冷却水系统中的铜、铜合金和钢表面。在某些实施例中，将带有阴离子取代基与三唑的氮原子结合的芳香族三唑（ANST）用作腐蚀抑制剂。在其他实施例中，腐蚀抑制剂是芳香族三唑和醛的反应产物（ATA）。
• NITROGEN SUBSTITUTED AROMATIC TRIAZOLES AS CORROSION CONTROL AGENTS
  申请人：General Electric Company

  公开号：EP3455394A1

  公开（公告）日：2019-03-20
• Antiinflammatory and antinociceptive activities of some benzotriazolylalkanoic acids
  作者：Alessandro Boido、Iana Vazzana、Francesca Mattioli、Fabio Sparatore

  DOI：10.1016/s0014-827x(02)00003-4

  日期：2003.1

  Sets of benzotriazol-1/2-ylalkanoic acids (1, 2, 3) and benzotriazol-1-yloxyalkanoic acids (4, 5) were prepared and tested for antiinflammatory activity; when significant activity was observed also the antinociceptive activity was explored. While the acids of structure 1, 4 and 5 were devoid of antiinflammatory action, most 2-(benzotriazol-1/2-yl)propionic acids (2, 3) exhibited significant activity as antiinflammatory and antinociceptive agents, with compound 2c and 3a being the most active in the two assays, respectively. The dextrorotatory enantiomer of 2c ((+)-2c) was also prepared and found to be practically as active as the racemic mixture, though some differences in the steepness of the dose-response curves were observed.
• Korlipara; Takemori; Portoghese, Journal of Medicinal Chemistry, 1995, vol. 38, # 8, p. 1337 - 1343
  作者：Korlipara、Takemori、Portoghese

  DOI：——

  日期：——