Tag: M.W=300-400

Recommanded Product: 92-86-4. In 2021 MOL CATAL published article about CROSS-COUPLING REACTIONS; ROOM-TEMPERATURE; C-C; PHENYLBORONIC ACID; SUZUKI-MIYAURA; ARYL MESYLATES; WATER EXTRACT; BORONIC ACIDS; COPPER; EFFICIENT in [Appa, Rama Moorthy; Lakshmidevi, Jangam; Naidu, Bandameeda Ramesh; Venkateswarlu, Katta] Yogi Vemana Univ, Dept Chem, Lab Synthet & Nat Prod Chem, Kadapa 516005, India in 2021, Cited 84. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4.

Symmetrical and unsymmetrical biaryls comprises a diverse class of biologically eloquent organic compounds. We herein report, a quick and eco-friendly protocol for the synthesis of biaryls by an oxidative (aerobic) homocoupling of arylboronic acids (ABAs) using Pd(OAc)(2) in water extract of pomogranate ash (WEPA) as an efficient agro-waste(bio)-derived aqueous (basic) media. The reactions were executed at ambient aerobic conditions in the absence of external base and ligand to result symmetrical biaryls in excellent yields. The use of renewable media with an effective exploitation of waste, short reaction times, excellent yields of products, easy separation of the products, unnecessating the external base, oxidant, ligand or volatile organic solvents and ambient reaction conditions are the vital insights of the present protocol.

Recommanded Product: 92-86-4. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Appa, RM; Lakshmidevi, J; Naidu, BR; Venkateswarlu, K or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Application In Synthesis of 4,4′-Dibromobiphenyl. Mroz, W; Kovalev, AI; Babushkina-Lebedeva, MA; Kushakova, NS; Vercelli, B; Squeo, BM; Botta, C; Pasini, M; Destri, S; Giovanella, U; Khotina, IA in [Mroz, Wojciech; Squeo, Benedetta M.; Botta, Chiara; Pasini, Mariacecilia; Destri, Silvia; Giovanella, Umberto] CNR, Ist Studio Macromol, Via Corti 12, I-20133 Milan, Italy; [Vercelli, Barbara] Inst Condensed Matter Chem & Technol Energy SS Mi, Via Cozzi 53, I-20125 Milan, Italy; [Kovalev, Aleksey I.; Babushkina-Lebedeva, Marina A.; Kushakova, Natalia S.; Khotina, Irina A.] Russian Acad Sci, AN Nesmeyanov Inst Organoelement Cpds, Vavilova Str 28, Moscow 119991, Russia published Branched Oligophenylenes with Phenylene-Ethynylene Fragments as Anode Interfacial Layer for Solution Processed Optoelectronics in 2019, Cited 33. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4.

Two branched oligophenylenethynylenes with phenylene or biphenylene moieties as inter-nodal fragments are synthesized by the Sonogashira reaction for optoelectronic applications. The branching of polyphenylenethynylenes influences the electro-optical properties, but cannot be precisely controlled, while its determination is often hardly addressed. The optical investigation, supported by nuclear magnetic resonance (NMR) studies, of oligophenylenethynylenes and the properly synthesized model compounds is performed to get insights on the branching and related effect on the material performance. The proposed branched oligophenylenethynylenes are good ultraviolet emitters in solution, while in solid-state aggregation phenomena strongly affect emission properties. However, the interactions between pi-electrons on phenylene and ethynylene of neighboring molecules in films enhance intermolecular charge transport (hole mobility = 3.2 x 10(-3) cm(2) V(-1)s(-1)) making them optimal candidates as hole transport materials in optoelectronic devices. The insertion of the oligophenylenethynylene film as a hole transporting layer in multilayered solution processes blue, green, and red electroluminescent diodes, enhances OLEDs electro-optical properties.

Application In Synthesis of 4,4′-Dibromobiphenyl. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Mroz, W; Kovalev, AI; Babushkina-Lebedeva, MA; Kushakova, NS; Vercelli, B; Squeo, BM; Botta, C; Pasini, M; Destri, S; Giovanella, U; Khotina, IA or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Safety of 4,4′-Dibromobiphenyl. In 2020 TETRAHEDRON LETT published article about COUPLING REACTIONS; BIARYLS; ARYL; BASE; COMPLEX; LIGAND in [Li, Min-Xin; Tang, Yan-Ling; Gao, Hui; Mao, Ze-Wei] Yunnan Univ Chinese Med, Coll Pharmaceut Sci, Kunming 650500, Yunnan, Peoples R China in 2020, Cited 39. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4.

An efficient, mild and practical method was developed for the synthesis of biaryls via the Pd-catalyzed oxidative homocoupling of aromatic/heteroaromatic boronic acids in aqueous NaClO. (C) 2020 Elsevier Ltd. All rights reserved.

Safety of 4,4′-Dibromobiphenyl. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Li, MX; Tang, YL; Gao, H; Mao, ZW or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

An article Bis[pyrrolyl Ru(ii)] triads: a new class of photosensitizers for metal-organic photodynamic therapy WOS:000590392400005 published article about EXCITED-STATE DYNAMICS; ANTITUMOR IMMUNITY; SINGLET OXYGEN; PHOTOPHYSICAL PROPERTIES; RUTHENIUM(II) COMPLEXES; POLYPYRIDYL COMPLEXES; CHARGE SEPARATION; LIGAND; DYADS; DNA in [Smithen, Deborah A.; Diaz-Rodriguez, Roberto M.; Thompson, Alison] Dalhousie Univ, Dept Chem, POB 15000, Halifax, NS B3H 4R2, Canada; [Monro, Susan; Pinto, Mitch; Yin, Huimin] Acadia Univ, Dept Chem, Wolfville, NS B4P 2R6, Canada; [Roque, John, III] Univ N Carolina, Dept Chem & Biochem, POB 26170, Greensboro, NC 27402 USA; [Roque, John, III; Cameron, Colin G.; McFarland, Sherri A.] Univ Texas Arlington, Dept Chem & Biochem, 700 Planetarium Pl, Arlington, TX 76019 USA in 2020, Cited 90. Name: 4,4′-Dibromobiphenyl. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4

A new family of ten dinuclear Ru(ii) complexes based on the bis[pyrrolyl Ru(ii)] triad scaffold, where two Ru(bpy)(2) centers are separated by a variety of organic linkers, was prepared to evaluate the influence of the organic chromophore on the spectroscopic and in vitro photodynamic therapy (PDT) properties of the compounds. The bis[pyrrolyl Ru(ii)] triads absorbed strongly throughout the visible region, with several members having molar extinction coefficients (epsilon) >= 10(4) at 600-620 nm and longer. Phosphorescence quantum yields (phi(p)) were generally less than 0.1% and in some cases undetectable. The singlet oxygen quantum yields (phi(Delta)) ranged from 5% to 77% and generally correlated with their photocytotoxicities toward human leukemia (HL-60) cells regardless of the wavelength of light used. Dark cytotoxicities varied ten-fold, with EC50 values in the range of 10-100 mu M and phototherapeutic indices (PIs) as large as 5400 and 260 with broadband visible (28 J cm(-2), 7.8 mW cm(-2)) and 625 nm red (100 J cm(-2), 42 mW cm(-2)) light, respectively. The bis[pyrrolyl Ru(ii)] triad with a pyrenyl linker (5h) was especially potent, with an EC50 value of 1 nM and PI > 27 000 with visible light and subnanomolar activity with 625 nm light (100 J cm(-2), 28 mW cm(-2)). The lead compound 5h was also tested in a tumor spheroid assay using the HL60 cell line and exhibited greater photocytotoxicity in this more resistant model (EC50 = 60 nM and PI > 1200 with 625 nm light) despite a lower dark cytotoxicity. The in vitro PDT effects of 5h extended to bacteria, where submicromolar EC50 values and PIs >300 against S. mutans and S. aureus were obtained with visible light. This activity was attenuated with 625 nm red light, but PIs were still near 50. The ligand-localized (3)pi pi* state contributed by the pyrenyl linker of 5h likely plays a key role in its phototoxic effects toward cancer cells and bacteria.

Name: 4,4′-Dibromobiphenyl. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Smithen, DA; Monro, S; Pinto, M; Roque, J; Diaz-Rodriguez, RM; Yin, HM; Cameron, CG; Thompson, A; McFarland, SA or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Quality Control of 4,4′-Dibromobiphenyl. Recently I am researching about BINAPHTHYL DERIVATIVES; CHOLESTERIC MESOPHASE; PEDOT DERIVATIVES; SELF-ORGANIZATION; POLY(3,4-ETHYLENEDIOXYTHIOPHENE); ELECTROCHROMISM; POLYACETYLENE; FILMS; CONFORMATION; INDUCTION, Saw an article supported by the Ministry of Education, Culture, Sports, Science and Technology, JapanMinistry of Education, Culture, Sports, Science and Technology, Japan (MEXT) [13370214, 15K13706]. Published in WILEY-V C H VERLAG GMBH in WEINHEIM ,Authors: Yamakawa, S; Wada, K; Hidaka, M; Hanasaki, T; Akagi, K. The CAS is 92-86-4. Through research, I have a further understanding and discovery of 4,4′-Dibromobiphenyl

Ionic liquids bearing both liquid crystallinity and chirality are potentially applicable for chiral electrochemical syntheses and polymerizations. In this study, two types of chiral nematic liquid-crystalline ionic liquids (N*-LCILs) are developed to achieve asymmetric electrochemical polymerization without a supporting electrolyte and even a chiral dopant. N*-LCILs are prepared i) by adding an axially chiral binaphthyl derivative as an external chiral dopant to imidazolium cation-based LCILs or ii) by incorporating a chiral binaphthyl phosphate as a counter anion in LCILs. Helical poly(3,4-ethylenedioxythiophene) (H-PEDOT) films are successfully synthesized through electrochemical polymerization of a dimer- or trimer-type 3,4-ethylenedioxythiophene (EDOT) monomer in an N*-LCIL, where N*-LCIL plays the role of both an asymmetric solvent and a supporting electrolyte. H-PEDOT films have helically pi-stacked structures of conjugated chains and spiral morphologies consisting of one-handed screwed fibril bundles. The plausible mechanism of the asymmetric electrochemical polymerization of EDOT in N*-LCIL is proposed to elucidate the correlation of helical sense between the helically pi-stacked chains, screwed fibril bundles, and N*-LCIL. The two present types of N*-LCILs are the first to enable supporting electrolyte-free asymmetric electrochemical polymerization, and they have potential applications in various types of chiral electrochemical syntheses, expanding the potential utility of ionic liquids.

About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Yamakawa, S; Wada, K; Hidaka, M; Hanasaki, T; Akagi, K or concate me.. Quality Control of 4,4′-Dibromobiphenyl

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Recently I am researching about EXCITED-STATE ABSORPTION; OPTICAL-PROPERTIES; SPECTRA; LUMINESCENCE; FLUORESCENCE; POLYPHENYLS; DYNAMICS; SYSTEMS, Saw an article supported by the Russian Ministry of Science and Higher Education; Russian Foundation for Basic ResearchRussian Foundation for Basic Research (RFBR) [18-29-17006]; Ministry of Science and Higher Education of the Russian Federation; State of Bavaria within the Solar Technologies Go Hybrid (SolTech)” research program; [NSh-5698.2018.3]. Published in ROYAL SOC CHEMISTRY in CAMBRIDGE ,Authors: Ponomarenko, SA; Surin, NM; Skorotetcky, MS; Borshchev, OV; Pisarev, SA; Svidchenko, EA; Fedorov, YV; Molins, F; Brixner, T. The CAS is 92-86-4. Through research, I have a further understanding and discovery of 4,4′-Dibromobiphenyl. Application In Synthesis of 4,4′-Dibromobiphenyl

We report on the first experimental and theoretical investigations of ultrafast intramolecular energy transfer for a novel class of highly luminescent materials – nanostructured organosilicon luminophores (NOLs). For this purpose we designed, synthesized and investigated a NOL, (POPOP)Si-2(3Ph-EH)(6), consisting of six p-terphenyl (3Ph) donor and 1,4-bis(5-phenyloxazol-2-yl)benzene (POPOP) acceptor luminophores – well-known laser dyes widely used in plastic scintillators as an activator and a spectral shifter, respectively. The NOL shows excellent optical properties – molar absorption coefficient up to 2.6 x 10(5) L mol(-1) cm(-1), photoluminescence quantum yield up to 96% and pseudo Stokes shift of 100 nm. Its intramolecular energy transfer efficiency determined from steady-state optical measurements was found to be 93%, while the excitation lifetime was less than 1 ns. For deeper understanding of the processes of intramolecular energy transfer within NOLs, ultrafast spectroscopy investigations of the NOL, model donor and acceptor luminophores were performed for the first time for this class of compounds. It was found that the time constant of the energy transfer from donor to acceptor luminophores within the NOL is tau(1) = 105 fs, which is significantly faster than the vibrational relaxation within the donor (ca. 400 fs). Based on these findings, a kinetic scheme of the electronic excitation energy deactivation processes in the NOL was developed. The results obtained not only directly prove that the mechanism of energy transfer within the NOLs is based on Forster resonance energy transfer of the excitation energy from donor to acceptor luminophores, but also highlight the advantages of NOLs and NOL-based materials for future photonics applications – fast and efficient plastic scintillators, scintillating fibers and other spectral shifting optical materials.

About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Ponomarenko, SA; Surin, NM; Skorotetcky, MS; Borshchev, OV; Pisarev, SA; Svidchenko, EA; Fedorov, YV; Molins, F; Brixner, T or concate me.. Application In Synthesis of 4,4′-Dibromobiphenyl

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

An article Synthesis of novel magnetic CoFe2O4-embedded MIL-101 with tetramethylammonium hydroxide for extraction of toxic flame retardants in environmental water samples WOS:000484764800001 published article about SOLID-PHASE EXTRACTION; METAL-ORGANIC FRAMEWORKS; COFE2O4 NANOPARTICLES; PHOSPHATE; MICROEXTRACTION; EXPOSURE; TETRABROMOBISPHENOL; METABOLITES; DUST; MOFS in [Yang, Jiahui; Ma, Kaixuan; Li, Nan; Gu, Xinyue; Miao, Shengchao; Zhang, Meixing; Yang, Jing; Cui, Shihai] Nanjing Normal Univ, Jiangsu Prov Key Lab Mat Cycling & Pollut Control, Jiangsu Collaborat Innovat Ctr Biomed Funct Mat, Jiangsu Key Lab Biomed Mat,Sch Chem & Mat Sci, Nanjing, Jiangsu, Peoples R China; [Cui, Shihai] Nanjing Lvshiyuan Environm Protect Technol Co LTD, Nanjing, Jiangsu, Peoples R China in 2020, Cited 47. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4. HPLC of Formula: C12H8Br2

Novel magnetic CoFe2O4-embedded MIL-101(Cr) with tetramethylammonium hydroxide (CoFe2O4/MIL-101T) was prepared through the facile hydrothermal method. Tetramethylammonium hydroxide acts as a template molecule and avoids the recrystallisation of terephthalic acid. The material was applied as the adsorbent in the magnetic solid-phase extraction (MSPE) process coupled with high-performance liquid chromatography to detect the five flame retardants in environmental water samples. Several parameters affecting MSPE efficiency were systematically investigated, such as MIL-101T content, material amount, desorption solvents, adsorption time, solution pH, theoretical maximum enrichment factor (EFmax) and the reusability. Under optimised conditions, good linearities were achieved for five flame retardants with correlation coefficients R-2 > 0.9961. The limits of detections for analytes at the signal-to-noise ratio of three were 0.013-0.071 mu g center dot L-1. This method was applied to the analysis of tap, pond, lake and river waters. The recoveries were in the range of 81.5 +/- 3.2-107.0 +/- 2.3% with the relative standard deviations ranging from 0.11% to 8.66% in four real water samples. The adsorption mechanism was the hydrophobic interaction between the material and the analytes besides pore adsorption action of the material.

About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Yang, JH; Ma, KX; Li, N; Gu, XY; Miao, SC; Zhang, MX; Yang, J; Cui, SH or concate me.. HPLC of Formula: C12H8Br2

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Shieh, MH; Liu, YH; Wang, CC; Jian, H; Lin, CN; Chen, YM; Huang, CY in [Shieh, Minghuey; Liu, Yu-Hsin; Wang, Chih-Chin; Jian, Huan; Lin, Chien-Nan; Chen, Yen-Ming; Huang, Chung-Yi] Natl Taiwan Normal Univ, Dept Chem, Taipei 11677, Taiwan published A comparative study on NHC-functionalized ternary Se/Te-Fe-Cu compounds: synthesis, catalysis, and the effect of chalcogens in 2019, Cited 80. Quality Control of 4,4′-Dibromobiphenyl. The Name is 4,4′-Dibromobiphenyl. Through research, I have a further understanding and discovery of 92-86-4.

A novel family of N-heterocyclic carbene (NHC)-incorporated Se-Fe-Cu compounds, bis-1,3-dimethylimidazol-2-ylidene (bis-Me-2-imy)-containing compound [(mu(4)-Se)Fe-3(CO)(9){Cu(Me-2-imy)}(2)] (2), bis-N-methyl- or bis-N-isopropyl-substituted benzimidazol-2-ylidene (bis-Me-2-bimy or bis-Pr-i(2)-bimy)-incorporated compounds [(mu(4)-Se)Fe-3(CO)(9){Cu(Me-2-bimy)}(2)] (3) or [(mu(4)-Se)Fe-3(CO)(9){Cu(Pr-i(2)-bimy)}(2)] (4), and a bis-1,3-dimethyl-4,5-dichloroimidazol-2-ylidene (bis-Me-2-Cl-2-imy)-containing compound [(mu(3)-Se)Fe-3(CO)(9){Cu(Me-2-Cl-2-imy)}(2)] (5), were synthesized in moderate yields in facile one-pot reactions of the ternary pre-designed compound [(mu(3)-Se)Fe-3(CO)(9){Cu(MeCN)}(2)] (1) with the corresponding imidazolium salts and (KOBu)-Bu-t in THF in an ice-water bath. Single-crystal X-ray analyses revealed that the Me-2-imy compound 2 or the Me-2-bimy compound 3 each exhibited a trigonal bipyramidal SeFe3(CO)(9)Cu geometry with an Fe2Cu plane further capped by a Cu(Me-2-imy) or Cu(Me-2-bimy) fragment, respectively, with one long Cu-Cu covalent bond. In addition, compound 4 also comprised a trigonal bipyramidal SeFe3(CO)(9)Cu core structure, but the second Cu(Pr-i(2)-bimy) group bridged the equatorial Fe-Fe edge with two unbonded Cu atoms, due to the presence of a sterically bulky Pr-i(2)-bimy fragment. On the other hand, the strong electron-withdrawing chloro-containing NHC compound 5 showed a comparatively open tetrahedral SeFe3(CO)(9) metal core, where two Fe-Fe edges each were further bridged by a Cu(Me-2-Cl-2-imy) fragment. Due to the nonclassical C-H center dot center dot center dot O(carbonyl) hydrogen bonds between the CO groups of the SeFe3(CO)(9)Cu-2 core and CH moieties of the neighboring NHC ligands, both compounds 2 and 3 comprised a one-dimensional network, while compounds 4 and 5 each were made up of a two-dimensional framework in the solid state, which efficiently enhanced the stability of these Se-Fe-Cu NHC compounds. Importantly, all of these synthesized Se-Fe-Cu NHC compounds 2-5 had pronounced catalytic activities for the homocoupling of arylboronic acids with high catalytic yields. Finally, these Se-containing Fe-Cu NHC compounds further represented excellent models for studying chalcogen effects in comparison to their Te analogs, as demonstrated by their catalytic performances and electrochemical behaviors, and by DFT calculations.

About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Shieh, MH; Liu, YH; Wang, CC; Jian, H; Lin, CN; Chen, YM; Huang, CY or concate me.. Quality Control of 4,4′-Dibromobiphenyl

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Recently I am researching about CONJUGATED POLYELECTROLYTES; SYNTHETIC POLYELECTROLYTES; METATHESIS; ANNULATION; ACID; EFFICIENCY; POLYMERS; CATIONS, Saw an article supported by the National Science Foundation of ChinaNational Natural Science Foundation of China (NSFC) [21788102, 21674040]; Research Grants Council of Hong KongHong Kong Research Grants Council [16308116, C6009 -17G, A-HKUST605/16]; Innovation and Technology Commission [ITC-CNERC14SCO1, ITS/254/17]; National Key Research and Development program of China [2018YFE0190200]; Science and Technology Plan of Shen-zhen [JCYJ20170818113530705, JCYJ20180306180231853]; Natural Science Foundation for Distinguished Young Scholars of Guangdong Province [2016A030306013]; Pearl River Young Talents Program of Science and Technology in Guangzhou [201906010047]. Application In Synthesis of 4,4′-Dibromobiphenyl. Published in AMER CHEMICAL SOC in WASHINGTON ,Authors: Liu, XL; Li, MG; Han, T; Cao, B; Qiu, ZJ; Li, YY; Li, QY; Hu, YB; Liu, ZY; Lam, JWY; Hu, XL; Tang, BZ. The CAS is 92-86-4. Through research, I have a further understanding and discovery of 4,4′-Dibromobiphenyl

Polyelectrolytes play an important role in both natural biological systems and human society, and their synthesis, functional exploration, and profound application are thus essential for biomimicry and creating new materials. In this study, we developed an efficient synthetic methodology for in situ generation of azonia-containing polyelectrolytes in a one-pot manner by using readily accessible nonionic reactant in the presence of commercially available cheap ionic species. The resulting polyelectrolytes are emissive in the solid state and can readily form luminescent photopatterns with different colors. The azonia-containing polyelectrolytes possess extraordinary potency of reactive oxygen species (ROS) generation, enabling them to impressively kill methicillin-resistant Staphylococcus aureus (MRSA), a drug resistant superbug, both in vitro and in vivo.

Application In Synthesis of 4,4′-Dibromobiphenyl. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Liu, XL; Li, MG; Han, T; Cao, B; Qiu, ZJ; Li, YY; Li, QY; Hu, YB; Liu, ZY; Lam, JWY; Hu, XL; Tang, BZ or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Recently I am researching about ACTIVATED DELAYED FLUORESCENCE; LIGHT-EMITTING-DIODES; MOLECULAR-ORBITAL METHODS; BIPOLAR HOST MATERIALS; HIGH-EFFICIENCY; BLUE ELECTROPHOSPHORESCENCE; INTERMOLECULAR INTERACTIONS; DEGRADATION MECHANISMS; ELECTRONIC-STRUCTURE; THEORETICAL INSIGHT, Saw an article supported by the National Natural Science Foundation of ChinaNational Natural Science Foundation of China (NSFC) [21403037]; National Research Foundation of Korea (NRF) – Ministry of Education, Science, and TechnologyMinistry of Education, Science and Technology, Republic of KoreaNational Research Foundation of Korea [2015R1D1A1A01061487]. Published in AMER CHEMICAL SOC in WASHINGTON ,Authors: Li, HF; Hong, MK; Scarpaci, A; He, XY; Risko, C; Sears, JS; Barlow, S; Winget, P; Marder, SR; Kim, D; Bredas, JL. The CAS is 92-86-4. Through research, I have a further understanding and discovery of 4,4′-Dibromobiphenyl. Computed Properties of C12H8Br2

Aryl sulfones and phosphine oxides are widely used as molecular building blocks for host materials in the emissive layers of organic light-emitting diodes. In this context, the chemical stability of such molecules in the triplet state is of paramount concern to long-term device performance. Here, we explore the triplet excited-state (T-1) chemical stabilities of aryl sulfonyl and aryl phosphoryl molecules by means of UV absorption spectroscopy and density functional theory calculations. Both the sulfur-carbon bonds of the aryl sulfonyl molecules and the phosphorus-carbon bonds of aryl phosphoryl derivatives are significantly more vulnerable to dissociation in the T-1 state when compared to the ground (S-0) state. Although the vertical S-0 -> T-1 transitions correspond to nonbonding -> pi-orbital transitions, geometry relaxations in the T-1 state lead to sigma-sigma* character over the respective sulfur-carbon or phosphorus carbon bond, a result of significant electronic state mixing, which facilitates bond dissociation. Both the activation energy for bond dissociation and the bond dissociation energy in the T-1 state are found to vary linearly with the adiabatic T-1-state energy. Specifically, as T-1 becomes more energetically stable, the activation energy becomes larger, and dissociation becomes less likely, that is, more endothermic or less exothermic. While substitutions of electron-donating or -accepting units onto the aryl sulfones and aryl phosphine oxides have only marginal influence on the dissociation reactions, extension of the pi-conjugation of the aryl groups leads to a significant reduction in the triplet energy and a considerable enhancement in the Ty-state chemical stabilities.

Computed Properties of C12H8Br2. About 4,4′-Dibromobiphenyl, If you have any questions, you can contact Li, HF; Hong, MK; Scarpaci, A; He, XY; Risko, C; Sears, JS; Barlow, S; Winget, P; Marder, SR; Kim, D; Bredas, JL or concate me.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem