scholarly journals Predicting biological effect as a function of the chemical structure and the primary physical and chemical properties of organic compounds.

1976 ◽  
Vol 13 ◽  
pp. 27-30 ◽  
Author(s):  
N G Andreyeshcheva
Keyword(s):  
Organic Compounds ◽  
Biological Effect ◽  
Chemical Structure ◽  
Chemical Properties ◽  
Physical And Chemical Properties ◽  
Physical And Chemical ◽  
And Chemical Properties

scholarly journals Analysis of oxidation degree of graphite oxide and chemical structure of corresponding reduced graphite oxide by selecting different-sized original graphite

RSC Advances ◽  
2018 ◽  
Vol 8 (31) ◽  
pp. 17209-17217 ◽  
Author(s):  
Lu Shen ◽  
Lihua Zhang ◽  
Kui Wang ◽  
Lijing Miao ◽  
Qiaofeng Lan ◽  
...  
Keyword(s):  
Graphite Oxide ◽  
Chemical Structure ◽  
Chemical Properties ◽  
Thermal Reduction ◽  
Physical And Chemical Properties ◽  
Oxidation Degree ◽  
Reduced Graphite Oxide ◽  
Physical And Chemical ◽  
And Chemical Properties

The thermal reduction of GO is the most commonly used strategy for preparation of rGO, and the oxidation degree of GO would influence the chemical structure of prepared rGO, thereby affecting its physical and chemical properties.

scholarly journals A New Method to Find the Wiener Index of Hypergraphs

2020 ◽  
Vol 2020 ◽  
pp. 1-6
Author(s):  
Yalan Li ◽  
Bo Deng
Keyword(s):  
Organic Compounds ◽  
Chemical Properties ◽  
Wiener Index ◽  
New Method ◽  
Physical And Chemical Properties ◽  
Mathematical Chemistry ◽  
Physical And Chemical ◽  
And Chemical Properties

The Wiener index is defined as the summation of distances between all pairs of vertices in a graph or in a hypergraph. Both models—graph-theoretical and hypergraph-theoretical—are used in mathematical chemistry for quantitatively studying physical and chemical properties of classical and nonclassical organic compounds. In this paper, we consider relationships between hypertrees and trees and hypercycles and cycles with respect to their Wiener indices.

scholarly journals Topological Aspects of Boron Nanotubes

2018 ◽  
Vol 2018 ◽  
pp. 1-11 ◽  
Author(s):  
Jia-Bao Liu ◽  
Hani Shaker ◽  
Imran Nadeem ◽  
Muhammad Hussain
Keyword(s):  
Thermal Stability ◽  
Electronic Properties ◽  
Chemical Structure ◽  
Chemical Properties ◽  
Topological Indices ◽  
The Other ◽  
Theoretical Studies ◽  
Physical And Chemical Properties ◽  
Physical And Chemical ◽  
And Chemical Properties

The degree-based topological indices are used to correlate the physical and chemical properties of a molecule with its chemical structure. Boron nanotubular structures are high-interest materials due to the presence of multicenter bonds and have novel electronic properties. These materials have some important issues in nanodevice applications like mechanical and thermal stability. Therefore, they require theoretical studies on the other properties. In this paper, we present certain degree-based topological indices such as ABC, the fourth ABC, GA, and the fifth GA indices for boron triangular and boron-α nanotubes.

scholarly journals The absorption spectra of the vapours of benzene and its homologues at different temperatures and pressures, and likewise of solutions of benzene

1908 ◽  
Vol 80 (537) ◽  
pp. 162-165 ◽  
Keyword(s):  
Absorption Spectra ◽  
Chemical Structure ◽  
Constant Pressure ◽  
Chemical Properties ◽  
Complete Agreement ◽  
Physical And Chemical Properties ◽  
Different Temperatures ◽  
Temperature And Pressure ◽  
Physical And Chemical ◽  
And Chemical Properties

The author having been engaged since the year 1877 in investigating and correlating the physical and chemical properties of aromatic substances in relation to their chemical structure or constitution, he has latterly found it desirable that several very definite compounds should be examined in a state of vapour, as well as in solution. The work of E. Pauer, W. Friederichs, and of L. Grebe is referred to in detail. The vapours of benzene and several of its derivatives have been examined (1) at different temperatures and constant pressure; and (2) at different pressures, the temperature being constant. The previous measurements of Pauer, Friederichs, and Grebe have been confirmed, and reconciled where they do not show complete agreement with each other. The records of temperature and pressure, and the shortening of the exposure of the photographic plates, constitute important differences between the work of the former investigators and that of the author.

scholarly journals Cyclodextrins: Structural, Chemical, and Physical Properties, and Applications

2021 ◽  
Vol 3 (1) ◽  
pp. 1-31
Author(s):  
Benjamin Gabriel Poulson ◽  
Qana A. Alsulami ◽  
Abeer Sharfalddin ◽  
Emam. F. El Agammy ◽  
Fouzi Mouffouk ◽  
...  
Keyword(s):  
Organic Compounds ◽  
Chemical Properties ◽  
Aqueous Solubility ◽  
Industrial Applications ◽  
Physical And Chemical Properties ◽  
To Come ◽  
Novel Applications ◽  
Physical And Chemical ◽  
And Chemical Properties

Due to their unique structural, physical and chemical properties, cyclodextrins and their derivatives have been of great interest to scientists and researchers in both academia and industry for over a century. Many of the industrial applications of cyclodextrins have arisen from their ability to encapsulate, either partially or fully, other molecules, especially organic compounds. Cyclodextrins are non-toxic oligopolymers of glucose that help to increase the solubility of organic compounds with poor aqueous solubility, can mask odors from foul-smelling compounds, and have been widely studied in the area of drug delivery. In this review, we explore the structural and chemical properties of cyclodextrins that give rise to this encapsulation (i.e., the formation of inclusion complexes) ability. This review is unique from others written on this subject because it provides powerful insights into factors that affect cyclodextrin encapsulation. It also examines these insights in great detail. Later, we provide an overview of some industrial applications of cyclodextrins, while emphasizing the role of encapsulation in these applications. We strongly believe that cyclodextrins will continue to garner interest from scientists for many years to come, and that novel applications of cyclodextrins have yet to be discovered.

scholarly journals Synthesis and structural features of 5-(4-(tert-butyl) phenyl)-4-((R)amino)-4H-1,2,4-triazole-3-thiols

2018 ◽  
pp. 60-65
Author(s):  
I. I. Aksyonova-Seliuk ◽  
O. I. Panasenko ◽  
E. G. Knysh
Keyword(s):  
Chemical Structure ◽  
Chemical Properties ◽  
Biologically Active ◽  
Physical And Chemical Properties ◽  
Tert Butyl ◽  
New Compounds ◽  
Physical And Chemical ◽  
Derivatives Of ◽  
Active Substances ◽  
And Chemical Properties

Chemistry of heterocyclic compounds is one of the most popular sector in organic chemistry. Scientists allocate among them a class of derivatives of 1,2,4-triazole. This class of compounds attracts attention his broad spectrum of biological activity. There are antiviral, anti-inflammatory, anti-tubercular, antimicrobial, antioxidant, actoprotective, anti-cancer and other activities. The derivatives of 1,2,4-triazole have one more important advantage. It is low toxicity. This properties do this class of derivatives promising for researches their chemical structure and biological activity and purposeful search of biologically active substances. The purpose of the work is synthesis of 5-(4-(tert-butyl)phenyl)-4-((R)amino)-4H-1,2,4-triazoles-3-thiols from appropriate ylidene derivatives of 4-amino-5-(4 (tert-butyl)phenyl)-4H-1,2,4-triazoles-3-thiol and research of their physical and chemical properties. The objects of research were 10 new compounds, derivatives of 4-amino-5-(4-(tert-butyl)phenyl)-4H-1,2,4-triazoles-3-thiol. These compounds are the crystal substances which are odorless, insoluble in water and soluble in organic solvents. Investigation of the physical and chemical properties of this compounds was carried out according to the methods listed in the State Pharmacopoeia of Ukraine. The melting temperature of synthesized compounds was determined by device OptiMelt Stanford Research Systems MPA100. The structure of the compound was confirmed by 1H-NMR spectroscopy (Mercury 400) and gas chromatography-mass spectrometry (Agilent 1260 Infinity HPLC). 10 new compounds, derivatives of 4-amino-5-(4-(tert-butyl)phenyl)-4H-1,2,4-triazoles-3-thiol, were synthesized in a study. The chemical structure of the new compounds was confirmed by modern instrumental methods of analysis. Results of the done work can be use in the future search of biologically active substances.

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