Quantum chemical calculations for reaction prediction in the development of synthetic methodologies
H Hayashi, S Maeda, T Mita - Chemical Science, 2023 - pubs.rsc.org
Quantum chemical calculations have been used in the development of synthetic
methodologies to analyze the reaction mechanisms of the developed reactions. Their ability …
methodologies to analyze the reaction mechanisms of the developed reactions. Their ability …
Cu-Catalyzed amination of base-sensitive aryl bromides and the chemoselective N-and O-arylation of amino alcohols
MJ Strauss, KX Liu, ME Greaves, JC Dahl… - Journal of the …, 2024 - ACS Publications
We report a general and functional-group-tolerant method for the Cu-catalyzed amination of
base-sensitive aryl bromides including substrates possessing acidic functional groups and …
base-sensitive aryl bromides including substrates possessing acidic functional groups and …
Cross-coupling by a noncanonical mechanism involving the addition of aryl halide to Cu (II)
Copper complexes are widely used in the synthesis of fine chemicals and materials to
catalyze couplings of heteroatom nucleophiles with aryl halides. We show that cross …
catalyze couplings of heteroatom nucleophiles with aryl halides. We show that cross …
Copper nanoclusters: emerging photoredox catalysts for organic bond formations
Advancements in fine chemical synthesis and drug discovery continuously demand the
development of new and more efficient catalytic systems. In this regard, numerous transition …
development of new and more efficient catalytic systems. In this regard, numerous transition …
Predicting success in Cu-catalyzed C–N coupling reactions using data science
Data science is assuming a pivotal role in guiding reaction optimization and streamlining
experimental workloads in the evolving landscape of synthetic chemistry. A discipline-wide …
experimental workloads in the evolving landscape of synthetic chemistry. A discipline-wide …
6‐Hydroxy Picolinohydrazides Promoted Cu (I)‐Catalyzed Hydroxylation Reaction in Water: Machine‐Learning Accelerated Ligands Design and Reaction …
L Xu, J Zhu, X Shen, J Chai, L Shi, B Wu… - Angewandte …, 2024 - Wiley Online Library
Hydroxylated (hetero) arenes are privileged motifs in natural products, materials, small‐
molecule pharmaceuticals and serve as versatile intermediates in synthetic organic …
molecule pharmaceuticals and serve as versatile intermediates in synthetic organic …
“Naked Nickel”-Catalyzed Amination of Heteroaryl Bromides
R Saeb, B Boulenger, J Cornella - Organic Letters, 2024 - ACS Publications
In this Letter, we report that the air-stable “naked nickel”[Ni (4-t Bustb) 3] is a competent
catalyst in thermal C–N bond formation between (hetero) aryl bromides and N-based …
catalyst in thermal C–N bond formation between (hetero) aryl bromides and N-based …
Adaptive photochemical amination via Co (II) catalysis
G Song, J Song, Q Li, T Kang, J Dong, G Li… - Journal of the …, 2024 - ACS Publications
Transition-metal-catalyzed amination of aryl halides is one of the most employed methods
for constructing N-arylation adducts. However, the broad success of these reactions largely …
for constructing N-arylation adducts. However, the broad success of these reactions largely …
Copper-Catalyzed Amination of Aryl Chlorides under Mild Reaction Conditions
We report a mild method for the copper-catalyzed amination of aryl chlorides. Key to the
success of the method was the use of highly sterically encumbered N 1, N 2-diaryl diamine …
success of the method was the use of highly sterically encumbered N 1, N 2-diaryl diamine …
C (sp 2)–S cross-coupling reactions with nickel, visible light, and mesoporous graphitic carbon nitride
Cross-coupling reactions play a vital role in modern organic synthesis, enabling the
construction of necessary C–C or C–(het) atom bonds for synthetic transformations …
construction of necessary C–C or C–(het) atom bonds for synthetic transformations …