2-氟吡啶-H(1+) | 59278-67-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 中文名称: 2-氟吡啶-H(1+)
• 英文名称: 2-fluoropyridine-H(1+)
• 英文别名: 3-fluoro-pyridinium cation；3-Fluor-pyridinium；3-Fluoropyridinium；3-Fluorpyridinium；3-Fluoropyridin-1-ium
• CAS: 59278-67-0
• 化学式: C₅H₅FN
• 分子量: 98.0998
• InChiKey: CELKOWQJPVJKIL-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  7
• 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：
  14.1
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  二茂铁 、 2-氟吡啶-H(1+) 生成 {Fe(η5-C5H5)2H}(1+)
  参考文献：
  名称：

  Ion chemistry of ferrocene. Thermochemistry of ionization and protonation and solvent clustering. Slow and entropy-driven proton-transfer kinetics

  摘要：

  DOI：

  10.1021/ja00190a014
• 作为产物：
  描述：

  3-氟吡啶 、 Aziridin-Kation 生成 乙烯亚胺 、 2-氟吡啶-H(1+)
  参考文献：
  名称：

  Proton affinities and photoelectron spectra of three-membered-ring heterocycles

  摘要：

  DOI：

  10.1021/ja00536a004
• 作为试剂：
  描述：

  三甘醇二甲醚 在 2-氟吡啶-H(1+) 作用下， 以 环己烷 为溶剂， 生成
  参考文献：
  名称：

  离子氢键。2. 分子内键和部分键。聚醚、冠醚和二酮的质子化

  摘要：

  La liaison intramoleculaire dans les ethers Crown Protones, Augmente les affinites protoniques de ces composes。质子化熵计算 les divers ethers Crown et des dicetones

  DOI：

  10.1021/ja00353a011

文献信息

• Gas-phase basicity measurements of dipeptides that contain valine
  作者：Greg S. Gorman、I. Jonathan Amster

  DOI：10.1021/ja00066a044

  日期：1993.6

  Gas-phase basicities of 22 dipeptides that contain valine were measured by a double bracketing method in a Fourier transform ion cyclotron resonance spectrometer. Matrix-assisted laser desorption was used to generate protonated peptide ions which were reacted with reference compounds to bracket the gas-phase basicity. In addition, neutral peptide molecules were formed by substrate-assisted laser desorption

  在傅里叶变换离子回旋共振光谱仪中通过双括号法测量了 22 种含有缬氨酸的二肽的气相碱度。基质辅助激光解吸用于产生质子化的肽离子，这些离子与参考化合物反应以保持气相碱性。此外，中性肽分子通过底物辅助激光解吸形成，并与质子化参考离子反应，以确认气相碱度的分配。测量丙氨酰缬氨酸的质子化分子与六种参考化合物之间的质子转移速率，以检查放热反应和吸热反应的行为。发现大多数二肽的气相碱度几乎等于它们最基本的氨基酸残基的气相碱度
• Hapiot, Philippe; Moiroux, Jacques; Savéant, Jean-Michel, Journal of the American Chemical Society, 1990, vol. 112, # 4, p. 1337 - 1343
  作者：Hapiot, Philippe、Moiroux, Jacques、Savéant, Jean-Michel

  DOI：——

  日期：——
• Steric and Kinetic Isotope Effects in the Deprotonation of Cation Radicals of NADH Synthetic Analogs
  作者：Agnes Anne、Sylvie Fraoua、Philippe Hapiot、Jacques Moiroux、Jean-Michel Saveant

  DOI：10.1021/ja00133a014

  日期：1995.7

  The deprotonation rate constants and kinetic isotope effects of the cation radicals have been determined by combined use of direct electrochemical techniques at micro- and ultramicroelectrodes, redox catalysis, and laser flash photolysis, over a extended series of opposing bases. Significant steric hindrance to deprotonation results from encumbering of the opposing base and of the functional carbon in the cation radical by alkyl groups. Kinetic isotope effects, ranging from 2 to 12 in terms of k(H)/k(D), appear upon substituting H to D at the functional carbon of the cation radical. The modest magnitude of the kinetic isotope effects and the fact that they are insensitive to steric hindrance show that proton (or H-atom) tunneling does not interfere significantly in the deprotonation reaction. All the cation radicals in the methylacridan series are strong acids, with pK(a)'s ranging from 0.8 to 1.7, as determined from thermodynamic cycles involving measured standard potentials and hydride-transfer equilibrium constants.
• The ionic hydrogen bond. 4. Intramolecular and multiple bonds. Protonation and complexes of amides and amino acid derivatives
  作者：Michael Meot-Ner

  DOI：10.1021/ja00314a003

  日期：1984.1
• Acid−Base Equilibrium between Phenoxyl−Nitronyl Nitroxide Biradical and Closed-Shell Cation. A Magnetic pH Sensor
  作者：Katsuya Ishiguro、Mitsutoshi Ozaki、Nobuyuki Sekine、Yasuhiko Sawaki

  DOI：10.1021/ja963289m

  日期：1997.4.1