Recommanded Product: m-Methoxyphenol. In 2021.0 COMPUT THEOR CHEM published article about RADICAL-MOLECULE REACTIONS; TRANSITION-STATE MODEL; THERMAL-DECOMPOSITION; LIGNOCELLULOSIC BIOMASS; ANISOLE PYROLYSIS; FLAME STRUCTURE; RATE CONSTANTS; KINETICS; OH; MECHANISM in [Wang, Quan-De; Sun, Mao-Mao] China Univ Min & Technol, Low Carbon Energy Inst, Xuzhou 221008, Jiangsu, Peoples R China; [Wang, Quan-De; Sun, Mao-Mao] China Univ Min & Technol, Sch Chem Engn, Xuzhou 221008, Jiangsu, Peoples R China; [Liang, Jinhu] North Univ China, Sch Environm & Safety Engn, Taiyuan 030051, Peoples R China in 2021.0, Cited 62.0. The Name is m-Methoxyphenol. Through research, I have a further understanding and discovery of 150-19-6.
The growing interest in the use of bio-oils requires a detailed understanding of its combustion chemical kinetics. Bio-oils contain a large variety of oxygenated organic species, in which substituted phenolic compounds are among the most significant fractions. Hence, accurate assessment of key reaction rate constants and systematically investigated the structural effect on the reactivity are critical. This work reports a systematic theoretical study of the hydrogen abstraction reactions from phenol, anisole, o-guaiacol, m-guaiacol, and p-guaiacol, which are considered as reference components in bio-oil surrogates. The hydrogen abstraction reactions by five different radicals (H/CH3/O(P-3)/OH/HO2) are investigated at ROCBS-QB3//M06-2X/cc-pVTZ level. The highpressure limit rate constants are computed via transition state theory with Eckart tunnelling and the 1-D hindered rotor approximation. Comparisons of site-specific hydrogen abstractions from the studied species with other related species are performed to understand the effects of the aromatic ring and side-chain substituent on hydrogen abstractions.
Recommanded Product: m-Methoxyphenol. Welcome to talk about 150-19-6, If you have any questions, you can contact Wang, QD; Sun, MM; Liang, JH or send Email.
Reference:
Indole alkaloid derivatives as building blocks of natural products from Bacillus thuringiensis and Bacillus velezensis and their antibacterial and antifungal activity study,
,Preparation of Indole Containing Building Blocks for the Regiospecific Construction of Indole Appended Pyrazoles and Pyrroles