2-氨基-3-巯基甲基-1,4-萘醌 | 72653-76-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 中文名称: 2-氨基-3-巯基甲基-1,4-萘醌
• 英文名称: 2-amino-3-mercaptomethyl-1,4-naphthoquinone
• 英文别名: 2-amino-3-methylmercapto-1,4-naphthoquinone；2-amino-3-methylsulfanyl-[1,4]naphthoquinone；2-Amino-3-methylmercapto-[1,4]naphthochinon；2-Amino-3-methylsulfanylnaphthalene-1,4-dione
• CAS: 72653-76-0
• 化学式: C₁₁H₉NO₂S
• 分子量: 219.264
• InChiKey: IPXSVTGNMZFRMM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  85.5
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-氨基-3-巯基甲基-1,4-萘醌 、 copper dichloride 在 tetrabutylammonium hydroxide 作用下， 以 乙醇 、 水 为溶剂， 生成
  参考文献：
  名称：

  Spectroscopic and electrochemical studies of NiII, CuII, PdII and VOII complexes with naphthoquinonic ligands

  摘要：

  The electron transfer complexes of general type [M(L(1))(2)], [M(L(2))(2)] and [M(L(3))(2)] with M = Ni-II, Cu-II, Pd-II and VOII ions have been investigated using 2-hydroxy-3-methylmercaptan-1,4-naphthoquinone (HL(1)), 2-amino-3-methylmercaptan-1,4-naphthoquinone (HL(2)) and 2,3-diamino-1,4-naphthoquinone (HL(3)) as ligands. Polarographic results confirmed that some the these neutral compounds underwent reversible or quasi-reversible one-electron reduction processes, and the reduction potentials for the [M(L(1))(2)] and [M(L(3))(2)] complexes were lower than those of the corresponding [M(L(2))(2)] complexes. EPR spectra of the prepared compounds, except the [Pd(L(2))(2)] complex, show that they are paramagnetic and some of them behave as free radicals stabilized through the cation. An attempt to correlate spectroscopic and redox parameters has been made. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0277-5387(96)00349-x
• 作为产物：
  描述：

  硫酸二甲酯 、 alkaline earth salt of/the/ methylsulfuric acid 在 乙醇 作用下， 生成 2-氨基-3-巯基甲基-1,4-萘醌
  参考文献：
  名称：

  Fries; Ochwat, Chemische Berichte, 1923, vol. 56, p. 1298

  摘要：

  DOI：

文献信息

• JPS54126725A
  申请人：——

  公开号：JPS54126725A

  公开（公告）日：1979-10-02
• Fries; Ochwat, Chemische Berichte, 1923, vol. 56, p. 1298
  作者：Fries、Ochwat

  DOI：——

  日期：——
• Spectroscopic and electrochemical studies of NiII, CuII, PdII and VOII complexes with naphthoquinonic ligands
  作者：Juan Camus、Aurelia Meghea、J.R. Anacona

  DOI：10.1016/s0277-5387(96)00349-x

  日期：1997.1

  The electron transfer complexes of general type [M(L(1))(2)], [M(L(2))(2)] and [M(L(3))(2)] with M = Ni-II, Cu-II, Pd-II and VOII ions have been investigated using 2-hydroxy-3-methylmercaptan-1,4-naphthoquinone (HL(1)), 2-amino-3-methylmercaptan-1,4-naphthoquinone (HL(2)) and 2,3-diamino-1,4-naphthoquinone (HL(3)) as ligands. Polarographic results confirmed that some the these neutral compounds underwent reversible or quasi-reversible one-electron reduction processes, and the reduction potentials for the [M(L(1))(2)] and [M(L(3))(2)] complexes were lower than those of the corresponding [M(L(2))(2)] complexes. EPR spectra of the prepared compounds, except the [Pd(L(2))(2)] complex, show that they are paramagnetic and some of them behave as free radicals stabilized through the cation. An attempt to correlate spectroscopic and redox parameters has been made. Copyright (C) 1996 Elsevier Science Ltd