145162-69-2Relevant academic research and scientific papers
Regioselective Synthesis, NMR, and Crystallographic Analysis of N1-Substituted Pyrazoles
Huang, Adrian,Wo, Kellie,Lee, So Yeun Christine,Kneitschel, Nika,Chang, Jennifer,Zhu, Kathleen,Mello, Tatsiana,Bancroft, Laura,Norman, Natalie J.,Zheng, Shao-Liang
, p. 8864 - 8872 (2017/09/11)
A systematic study of the N-substitution reactions of 3-substituted pyrazoles under basic conditions has been undertaken. Regioselective N1-alkylation, -arylation, and -heteroarylation of 3-substituted pyrazoles have been achieved using K2CO3-DMSO. The regioselectivity is justified by the DFT calculations at the B3LYP/6-31G??(d) level. A consistent steric effect on chemical shift has been observed for N-alkyl pyrazole analogues. Twenty-five X-ray crystallographic structures have been obtained to confirm the regiochemistry of the major products.
2-Substituted Pyrazole 1-Oxides. Preparation and Reaction with Electrophilic Reagents
Begtrup, Mikael,Larsen, Peter,Vedsoe, Per
, p. 972 - 980 (2007/10/02)
1-Substituted pyrazoles have been oxidized by peracids to 2-substituted pyrazole 1-oxides.This leads to a change in reactivity towards electrophilic attack. 2-Benzylpyrazole 1-oxide is brominated, chlorinated, and nitrated selectively at C-3.The 3-halo-su
