Primary Vinyl Ethers as Acetylene Surrogate: A Flexible Tool for Deuterium-Labeled Pyrazole Synthesis

Acetylene as a Dicarbene Equivalent for Gold(I) Catalysis: Total Synthesis of Waitziacuminone in One Step

(2020) Dagmar Scharnagel et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Oxidative C–H/C–H Annulation of Imidazopyridines and Indazoles through Rhodium-Catalyzed Vinylene Transfer

(2020) Koushik Ghosh et al.   ORGANIC LETTERS

Applications of deuterium in medicinal chemistry

(2019) Tracey Pirali et al.   JOURNAL OF MEDICINAL CHEMISTRY

GFN2-xTB—An Accurate and Broadly Parametrized Self-Consistent Tight-Binding Quantum Chemical Method with Multipole Electrostatics and Density-Dependent Dispersion Contributions

(2019) Christoph Bannwarth et al.   Journal of Chemical Theory and Computation

Synthesis of Exclusively 4-Substituted β-Lactams through the Kinugasa Reaction Utilizing Calcium Carbide

(2019) Abolfazl Hosseini et al.   ORGANIC LETTERS

Direct Synthesis of Deuterium-Labeled O-, S-, N-Vinyl Derivatives from Calcium Carbide

(2019) Maria Ledovskaya et al.   SYNTHESIS-STUTTGART

Mechanosynthesis of Odd-Numbered Tetraaryl[n ]cumulenes

(2019) Karen J. Ardila-Fierro et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Metal-Free Synthesis of Functional 1-Substituted-1,2,3-Triazoles from Ethenesulfonyl Fluoride and Organic Azides

(2019) Marie-Claire Giel et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Rhodium-Catalyzed Annulative Coupling Using Vinylene Carbonate as an Oxidizing Acetylene Surrogate

(2019) Koushik Ghosh et al.   ACS Catalysis

Deuterium- and Tritium-Labelled Compounds: Applications in the Life Sciences

(2018) Jens Atzrodt et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Using Calcium Carbide as an Acetylene Source for Cascade Synthesis of Pyrrolo[2,3-b ]quinoxalines via Copper-Free Sonogashira Coupling Reaction

(2018) Mahsa Fakharian et al.   HELVETICA CHIMICA ACTA

B97-3c: A revised low-cost variant of the B97-D density functional method

(2018) Jan Gerit Brandenburg et al.   JOURNAL OF CHEMICAL PHYSICS

[3 + 2]-Cycloaddition of in Situ Generated Nitrile Imines and Acetylene for Assembling of 1,3-Disubstituted Pyrazoles with Quantitative Deuterium Labeling

(2018) Vladimir V. Voronin et al.   JOURNAL OF ORGANIC CHEMISTRY

Calcium-mediated one-pot preparation of isoxazoles with deuterium incorporation

(2018) Maria S. Ledovskaya et al.   Organic Chemistry Frontiers

Acetylene in Organic Synthesis: Recent Progress and New Uses

(2018) Vladimir V. Voronin et al.   MOLECULES

Pitfalls in Computational Modeling of Chemical Reactions and How To Avoid Them

(2018) Ho Ryu et al.   ORGANOMETALLICS

A solid acetylene reagent with enhanced reactivity: fluoride-mediated functionalization of alcohols and phenols

(2017) Georg Werner et al.   GREEN CHEMISTRY

A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions

(2017) Lars Goerigk et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Calcium Carbide: A Unique Reagent for Organic Synthesis and Nanotechnology

(2016) Konstantin S. Rodygin et al.   Chemistry-An Asian Journal

Synthesis of vinyl ethers of alcohols using calcium carbide under superbasic catalytic conditions (KOH/DMSO)

(2016) Ryosuke Matake et al.   GREEN CHEMISTRY

An efficient metal-free pathway to vinyl thioesters with calcium carbide as the acetylene source

(2016) Konstantin S. Rodygin et al.   GREEN CHEMISTRY

A base promoted multigram synthesis of aminoisoxazoles: valuable building blocks for drug discovery and peptidomimetics

(2016) Bohdan A. Chalyk et al.   RSC Advances

Palladium-Catalyzed Direct CH Arylation of Isoxazoles at the 5-Position

(2015) Masashi Shigenobu et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Expedient one-pot synthesis of pyrroles from ketones, hydroxylamine, and 1,2-dichloroethane

(2015) Boris A. Trofimov et al.   TETRAHEDRON

Synthesis of Aminocarbonyl N-Acylhydrazones by a Three-Component Reaction of Isocyanides, Hydrazonoyl Chlorides, and Carboxylic Acids

(2014) Mariateresa Giustiniano et al.   ORGANIC LETTERS

The “one pot” synthesis of 4,5-dihydrobenzo[g]indole and its 1-vinyl derivative from 1-tetralone, hydroxylamine, and dichloroethane in the system KOH-DMSO

(2014) A. V. Ivanov et al.   RUSSIAN CHEMICAL BULLETIN

The isotopic effects of deuteration on optoelectronic properties of conducting polymers

(2014) Ming Shao et al.   Nature Communications

Synthesis of diarylalkynes via tandem Sonogashira/decarboxylative reaction of aryl chlorides with propiolic acid

(2014) Xiang Li et al.   RSC Advances

Measuring Kinetic Isotope Effects in Enzyme Reactions Using Time-Resolved Electrospray Mass Spectrometry

(2013) Peter Liuni et al.   ANALYTICAL CHEMISTRY

Using Deuterium in Drug Discovery: Leaving the Label in the Drug

(2013) Thomas G. Gant   JOURNAL OF MEDICINAL CHEMISTRY

Heavy drugs draw heavy interest from pharma backers

(2013) Alla Katsnelson   NATURE MEDICINE

Polymer-Supported Vinyl Sulfone as an Efficient Reagent for the Synthesis of 3-Monosubstituted Isoxazoles

(2013) Guo-Jian Wu et al.   SYNTHETIC COMMUNICATIONS

On the Interpretation of Deuterium Kinetic Isotope Effects in CH Bond Functionalizations by Transition-Metal Complexes

(2012) Eric M. Simmons et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Supramolecular Binding Thermodynamics by Dispersion-Corrected Density Functional Theory

(2012) Stefan Grimme   CHEMISTRY-A EUROPEAN JOURNAL

Facile One-Pot Synthesis of Monosubstituted 1-Aryl-1H-1,2,3-triazoles from Arylboronic Acids and Prop-2-ynoic Acid (=Propiolic Acid) or Calcium Acetylide (=Calcium Carbide) as Acetylene Source

(2012) Qing Yang et al.   HELVETICA CHIMICA ACTA

A geometrical correction for the inter- and intra-molecular basis set superposition error in Hartree-Fock and density functional theory calculations for large systems

(2012) Holger Kruse et al.   JOURNAL OF CHEMICAL PHYSICS

Synopsis of Some Recent Tactical Application of Bioisosteres in Drug Design

(2011) Nicholas A. Meanwell   JOURNAL OF MEDICINAL CHEMISTRY

One-Pot Vinylation of Secondary Phosphine Chalcogenides with Vinyl Sulfoxides

(2010) Svetlana F. Malysheva et al.   PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS

Regioselectivity of a 1,3-dipolar cycloaddition to phenyl vinyl sulfoxide

(2009) Tyler C. Gray et al.   JOURNAL OF HETEROCYCLIC CHEMISTRY

In Vitro and In Vivo Isotope Effects with Hepatitis C Protease Inhibitors: Enhanced Plasma Exposure of Deuterated Telaprevir versus Telaprevir in Rats

(2009) François Maltais et al.   JOURNAL OF MEDICINAL CHEMISTRY

Simple, Convenient, and Efficient Synthesis of 2-Aryl-substituted Benzo[b]furans

(2009) Yong Jiang et al.   SYNTHETIC COMMUNICATIONS

Application of Stable Isotope-Labeled Compounds in Metabolism and in Metabolism-Mediated Toxicity Studies

(2008) Abdul E. Mutlib   CHEMICAL RESEARCH IN TOXICOLOGY

Palladium-Catalyzed Arylation and Alkylation of 3,5-Diphenylisoxazole with Boronic Acids via C−H Activation

(2008) Jean-Ho Chu et al.   ORGANOMETALLICS

Synthesis of 6-ethynylpurine derivatives

(2008) András Nagy et al.   TETRAHEDRON LETTERS

Ethynyl-cyclohexanol: an efficient acetylene surrogate in Sonogashira coupling

(2007) Márton Csékei et al.   TETRAHEDRON