How did you first get involved in researching Methyl 3-phenyl-2-propenoate

Quality Control of Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Qin, M; Wang, QQ; Du, YJ; Shao, LJ; Qi, CZ; Tao, HY or concate me.

An article Encapsulating palladium nanoparticles inside ethylenediamine functionalized and crosslinked chlorinated poly(vinyl chloride) nanofibers as an efficient and stable heterogeneous catalyst for coupling reactions WOS:000567084700018 published article about THERMAL-DECOMPOSITION; RECYCLABLE CATALYST; HECK REACTION; COMPLEX; LIGHT; FIBER in [Qin, Min; Wang, Qingqing; Du, Yijun; Shao, Linjun; Qi, Chenze; Tao, Hongyu] Shaoxing Univ, Zhejiang Key Lab Alternat Technol Fine Chem Proc, Shaoxing 312000, Zhejiang, Peoples R China in 2020.0, Cited 48.0. The Name is Methyl 3-phenyl-2-propenoate. Through research, I have a further understanding and discovery of 103-26-4. Quality Control of Methyl 3-phenyl-2-propenoate

Palladium chloride and chlorinated poly (vinyl chloride) (CPVC) mixture were prepared into homogeneous solution, followed by electrospinning to make uniform nanofibers with average diameter of similar to 460 nm. Then, these composite nanofibers were treated in ethylenediamine solution to functionalize and crosslink the CPVC molecules inside the nanofibers to improve their chelating ability and solvent resistance. The functionalization and crosslinking of CPVC molecules inside composite nanofibers were confirmed by SEM, FT-IR, EA and PALS characterizations. The catalytic performance of these palladium encapsulated CPVC nanofibers (Pd@ACPVC) have been evaluated by the Heck and Sonogashira reactions. The catalysis results demonstrate that this Pd@ACPVC catalyst was very effective and stable to catalyze the coupling reaction of aromatic iodides with alkenes (Heck reaction) or phenyl acetylene (Sonogashira reaction) to afford the coupling products in moderate to excellent yields. Due to the regular fibrous structure, the Pd@ACPVC could be readily separated and recovered from reaction mixture. In addition, the Pd@ACPVC could be separately reused for 10 times for Heck reaction and 8 times for Sonogashira reaction without significant decrement of coupling yields. After careful investigation, the palladium leaching from Pd@ACPVC in the reuse procedure could be ascribed to the loss of chelating groups (amino groups) and expansion of free volume holes in the composite nanofibers. The excellent catalytic activity and stability of Pd@ACPVC could be attributed to the strong chelating ability of amino groups, encapsulation of palladium nanoparticles and ultrafine fiber.

Quality Control of Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Qin, M; Wang, QQ; Du, YJ; Shao, LJ; Qi, CZ; Tao, HY or concate me.

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

The Best Chemistry compound:Methyl 3-phenyl-2-propenoate

About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Huang, Q; Zhang, FY; Liu, S; Jiang, YP; Ouyang, DS or concate me.. SDS of cas: 103-26-4

In 2021.0 BIOMED PHARMACOTHER published article about PERFORMANCE LIQUID-CHROMATOGRAPHY; DIABETIC-NEPHROPATHY; CHEMICAL-CONSTITUENTS; ANTIOXIDANT ACTIVITY; OXIDATIVE STRESS; PATHOGENESIS; PHYTOCHEMISTRY; GLUCOSE; ETHNOPHARMACOLOGY; RESISTANCE in [Huang, Qi; Zhang, Fengyu; Liu, Shao; Jiang, Yueping] Cent South Univ, Xiangya Hosp, Dept Pharm, Changsha 410008, Hunan, Peoples R China; [Huang, Qi; Ouyang, Dongsheng] Cent South Univ, Xiangya Hosp, Dept Clin Pharmacol, Changsha 410008, Hunan, Peoples R China; [Huang, Qi; Ouyang, Dongsheng] Cent South Univ, Inst Clin Pharmacol, Hunan Key Lab Phammcogenet, Changsha 410078, Hunan, Peoples R China; [Huang, Qi; Ouyang, Dongsheng] Changsha Duxact Biotech Co Ltd, Hunan Key Lab Bioanal Complex Matrix Samples, Changsha 411000, Hunan, Peoples R China; [Huang, Qi; Zhang, Fengyu; Liu, Shao; Jiang, Yueping; Ouyang, Dongsheng] Cent South Univ, Xiangya Hosp, Natl Clin Res Ctr Geriatr Disorders, Inst Rat & Safe Medicat Practices, Changsha 410008, Hunan, Peoples R China in 2021.0, Cited 48.0. The Name is Methyl 3-phenyl-2-propenoate. Through research, I have a further understanding and discovery of 103-26-4. SDS of cas: 103-26-4

Bark is the traditional medicinal component of Eucommia ulmoides Oliver (E. ulmoides). However, the demand for E. ulmoides medicinal materials seriously limits their sustainability. To alleviate resource constraints, the bioactivity of E. ulmoides leaves and its pharmacodynamic basis were investigated. In the present study, extracts of E. ulmoides leaves were found to display potential renal protective properties in rat glomerular mesangial (HBZY-1) cells treated with high levels of glucose, suggesting that they possess potential factors capable of treating diabetic nephropathy. Ultra-performance liquid chromatography tandem quadrupole time-of-flight mass spectrometry (UPLC-Q-TOF-MS) was used to comprehensively characterize the chemical components of E. ulmoides leaves. A total of 83 possible chemical components, including 12 iridoids, 13 flavonoids, 14 lignans, 20 phenylpropanoids, 14 phenolic acids, and 10 additional components, were identified in E. ulmoides leaves. Network pharmacology was used for a preliminary exploration of the potential mechanism of action of renal protection afforded by E. ulmoides leaves towards diabetic nephropathy. The network pharmacology results were verified using a series of biological experiments. The present study provided the basis for the comprehensive development and utilization of E. ulmoides leaves and the discovery of potential drugs.

About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Huang, Q; Zhang, FY; Liu, S; Jiang, YP; Ouyang, DS or concate me.. SDS of cas: 103-26-4

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Some scientific research about Methyl 3-phenylpropionate

About Methyl 3-phenylpropionate, If you have any questions, you can contact Pandit, RP; Kim, ST; Ryu, DH or concate me.. Recommanded Product: Methyl 3-phenylpropionate

In 2019.0 ANGEW CHEM INT EDIT published article about C-H INSERTION; ORTHO-QUINONE METHIDE; DONOR-ACCEPTOR CYCLOPROPANES; RING-OPENING CYCLIZATION; ENANTIOSELECTIVE SYNTHESIS; STEREOSELECTIVE-SYNTHESIS; 3+2 ANNULATION; CONSTRUCTION; DIAZOESTERS; AMINOCYCLOPROPANES in [Pandit, Rameshwar Prasad; Kim, Seung Tae; Ryu, Do Hyun] Sungkyunkwan Univ, Dept Chem, 300 Cheoncheon, Suwon 16419, South Korea in 2019.0, Cited 101.0. The Name is Methyl 3-phenylpropionate. Through research, I have a further understanding and discovery of 103-25-3. Recommanded Product: Methyl 3-phenylpropionate

A cyclopropanation/intramolecular rearrangement initiated by the Michael addition of in situ generated ortho-quinone methides (o-QMs) has been developed for the enantioselective synthesis of 2-aryl-2,3-dihydrobenzofurans containing two consecutive stereogenic centers, including a quaternary carbon atom. In the presence of a chiral oxazaborolidinium ion catalyst, the reaction proceeded in excellent yields (up to 95 %) with excellent stereoselectivity (up to >99 ee, up to >20:1 d.r.).

About Methyl 3-phenylpropionate, If you have any questions, you can contact Pandit, RP; Kim, ST; Ryu, DH or concate me.. Recommanded Product: Methyl 3-phenylpropionate

Reference:
Patent; SANOFI; US2011/294788; (2011); A1;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Why do aromatic interactions matter of compound:Methyl 3-phenylpropionate

Recommanded Product: 103-25-3. About Methyl 3-phenylpropionate, If you have any questions, you can contact Pandit, RP; Kim, ST; Ryu, DH or concate me.

An article Asymmetric Synthesis of Enantioenriched 2-Aryl-2,3-Dihydrobenzofurans by a Lewis Acid Catalyzed Cyclopropanation/Intramolecular Rearrangement Sequence WOS:000480981400001 published article about C-H INSERTION; ORTHO-QUINONE METHIDE; DONOR-ACCEPTOR CYCLOPROPANES; RING-OPENING CYCLIZATION; ENANTIOSELECTIVE SYNTHESIS; STEREOSELECTIVE-SYNTHESIS; 3+2 ANNULATION; CONSTRUCTION; DIAZOESTERS; AMINOCYCLOPROPANES in [Pandit, Rameshwar Prasad; Kim, Seung Tae; Ryu, Do Hyun] Sungkyunkwan Univ, Dept Chem, 300 Cheoncheon, Suwon 16419, South Korea in 2019.0, Cited 101.0. Recommanded Product: 103-25-3. The Name is Methyl 3-phenylpropionate. Through research, I have a further understanding and discovery of 103-25-3

A cyclopropanation/intramolecular rearrangement initiated by the Michael addition of in situ generated ortho-quinone methides (o-QMs) has been developed for the enantioselective synthesis of 2-aryl-2,3-dihydrobenzofurans containing two consecutive stereogenic centers, including a quaternary carbon atom. In the presence of a chiral oxazaborolidinium ion catalyst, the reaction proceeded in excellent yields (up to 95 %) with excellent stereoselectivity (up to >99 ee, up to >20:1 d.r.).

Recommanded Product: 103-25-3. About Methyl 3-phenylpropionate, If you have any questions, you can contact Pandit, RP; Kim, ST; Ryu, DH or concate me.

Reference:
Patent; SANOFI; US2011/294788; (2011); A1;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

What kind of challenge would you like to see in a future of compound:Methyl 3-phenyl-2-propenoate

Name: Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Sadjadi, S; Malmir, M; Heravi, MM; Raja, M or concate me.

Name: Methyl 3-phenyl-2-propenoate. Recently I am researching about SULFONIC-ACID GROUPS; HIGHLY-EFFICIENT; PHOSPHOMOLYBDIC ACID; SEPARABLE CATALYST; GREEN APPROACH; POSS POLYMERS; IONIC LIQUID; C-C; SONOGASHIRA; CHEMISTRY, Saw an article supported by the Iran Polymer and Petrochemical Institute; Alzahra University; Iran National Science FoundationIran National Science Foundation (INSF). Published in ELSEVIER SCIENCE BV in AMSTERDAM ,Authors: Sadjadi, S; Malmir, M; Heravi, MM; Raja, M. The CAS is 103-26-4. Through research, I have a further understanding and discovery of Methyl 3-phenyl-2-propenoate

For the first time a novel magnetic catalyst was prepared through hybridization of functionalized cyclodextrin nanosponges and octakis(3-chloropropyl)octasilsesquioxane followed by incorporation of Pd and magnetic nanoparticles. The resulting composite, was utilized as an efficient heterogeneous catalyst for promoting Sonogashira and Heck reactions in the absence of any ligand and co-catalyst under mild reaction condition. Comparison of the catalytic activities of the control catalysts and the catalyst confirmed that cyclodextrin nanosponges was more efficient support that cyclodextrin. Moreover, the hybrid catalyst showed superior catalytic activity compared to those obtained from the individual components, indicating the contribution of both hybrid components to the catalysis. Furthermore, it was found that incorporation of magnetic nanoparticles could improve the catalytic performance. The Study of the recyclability of the catalyst showed high recyclability of the catalyst as well as low Pd leaching. (C) 2019 Published by Elsevier B.V.

Name: Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Sadjadi, S; Malmir, M; Heravi, MM; Raja, M or concate me.

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Let`s talk about compound :103-26-4

HPLC of Formula: C10H10O2. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Shegavi, ML; Saini, S; Bhawar, R; Vishwantha, MD; Bose, SK or concate me.

Shegavi, ML; Saini, S; Bhawar, R; Vishwantha, MD; Bose, SK in [Shegavi, Mahadev L.; Saini, Suresh; Bhawar, Ramesh; Vishwantha, Meghana Desai; Bose, Shubhankar Kumar] JAIN, Ctr Nano & Mat Sci CNMS, Jain Global Campus, Bangalore 562112, Karnataka, India published Recyclable Copper Nanoparticles-Catalyzed Hydroboration of Alkenes and beta-Borylation of alpha,beta-Unsaturated Carbonyl Compounds with Bis(Pinacolato)Diboron in 2021.0, Cited 186.0. HPLC of Formula: C10H10O2. The Name is Methyl 3-phenyl-2-propenoate. Through research, I have a further understanding and discovery of 103-26-4.

Nano-ferrite-supported Cu nanoparticles (Fe-dopamine-Cu NPs) catalyzed anti-Markovnikov-selective hydroboration of alkenes with B(2)pin(2) is reported under mild reaction conditions. This protocol can be applied to a broad range of substrates with high functional group compatibility. In addition, we demonstrated the use of Fe-dopamine-Cu NPs as a catalyst for the beta-borylation of alpha,beta-unsaturated ketones and ester, providing alkylboronate esters in up to 98% yield. Reuse of the magnetically recyclable catalyst resulted in no significant loss of activity in up to five reaction runs for both systems.

HPLC of Formula: C10H10O2. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Shegavi, ML; Saini, S; Bhawar, R; Vishwantha, MD; Bose, SK or concate me.

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Machine Learning in Chemistry about C10H11NO4

COA of Formula: C10H11NO4. About Dimethyl 5-aminoisophthalate, If you have any questions, you can contact Karmakar, A; Paul, A; Rubio, GMDM; Soliman, MMA; Fatima, M; da Silva, CG; Pombeiro, AJL or concate me.

Recently I am researching about ACID; CATALYSIS; MOFS, Saw an article supported by the Foundation for Science and Technology (FCT), PortugalPortuguese Foundation for Science and Technology [UID/QUI/00100/2019]; Instituto Superior Tecnico; FCTPortuguese Foundation for Science and TechnologyEuropean Commission [IST-ID/107/2018, IST-ID/197/2019, 57/2016]. Published in FRONTIERS MEDIA SA in LAUSANNE ,Authors: Karmakar, A; Paul, A; Rubio, GMDM; Soliman, MMA; Fatima, M; da Silva, CG; Pombeiro, AJL. The CAS is 99-27-4. Through research, I have a further understanding and discovery of Dimethyl 5-aminoisophthalate. COA of Formula: C10H11NO4

A pyridine-based amide functionalized tetracarboxylic acid, 5,5 ‘-(pyridine-2, 6-dicarbonyl)bis(azanediyl)}diisophthalic acid (H4L), was synthesized and its coordination chemistry toward zinc(II) and cadmium(II) ions was studied. The reactions of H4L with Zn(NO3)(2).6H(2)O and Cd(NO3)(2).4H(2)O led to its full or partial deprotonation, respectively, and the formation of the 2D coordination polymers [Zn-2(L)(H2O)(4)](n).4n(H2O) (1) and [Cd-3(HL)(2)(DMF)(4)](n).4n(DMF) (2) (DMF = N,N’-dimethylformamide), respectively. They were characterized by elemental analysis, FT-IR, photoluminescence, thermogravimetry, and single-crystal and powder X-ray diffraction. In 1, the L4- ligand is planar with every carboxylate anion binding a Zn(II) cation and giving rise to a 2D grid with the metals with tetrahedral environments. In 2, the combination of bridging HL3- and dimethylformamide to form trinuclear Cd(II) clusters engenders secondary building block units and generates a layer-type 2D network with the metals with octahedral and pentagonal bipyramid coordination geometries. The topological analyses of 1 and 2 reveal 2,4-connected and 3,6-connected binodal nets, respectively. On account of the presence of Lewis acid (Zn or Cd centers) as well as basic (uncoordinated pyridine and amide groups) sites, 1 and (to a much lower extent) 2 effectively catalyze the one-pot cascade deacetalization-Knoevenagel condensation reactions under quite mild conditions. They act as heterogeneous catalysts, being easy to recover and recycle without losing activity.

COA of Formula: C10H11NO4. About Dimethyl 5-aminoisophthalate, If you have any questions, you can contact Karmakar, A; Paul, A; Rubio, GMDM; Soliman, MMA; Fatima, M; da Silva, CG; Pombeiro, AJL or concate me.

Reference:
Patent; ASTRA ZENECA AB; NPS PHARMACEUTICALS, INC.; WO2004/14881; (2004); A2;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

The important role of Methyl 3-phenylpropionate

Safety of Methyl 3-phenylpropionate. About Methyl 3-phenylpropionate, If you have any questions, you can contact Murray, AF; Moore, AJ; Munafo, JP or concate me.

Safety of Methyl 3-phenylpropionate. In 2020.0 J AGR FOOD CHEM published article about AROMA COMPOUNDS; VOLATILE COMPOUNDS; RAW; MUSHROOM; SING. in [Murray, Anne F.; Moore, Andrew J.; Munafo, John P., Jr.] Univ Tennessee, Dept Food Sci, Knoxville, TN 37996 USA in 2020.0, Cited 25.0. The Name is Methyl 3-phenylpropionate. Through research, I have a further understanding and discovery of 103-25-3.

The American Matsutake, Tricholoma magnivelare (Peck) Redhead, is an edible wild mushroom with a distinctive aroma described as mushroom and spice with subtle floral and citrus nuances. In this study, a total of 36 odorants were identified from T. magnivelare using solvent-assisted flavor evaporation and aroma extract dilution analysis. Stable isotope dilution assays were performed to quantitate 14 odorants with flavor dilution factors >= 64. Odorants with high odor activity values (OAVs) included 1-octen-3-one (OAV 2125), linalool (OAV 650), (2E,4E)-nona-2,4-dienal (OAV 304), and 1-octen-3-ol (OAV 206). An odor simulation model matched the odor profile of the fresh mushroom. Omission studies showed that linalool, hexanal, (2E,4E)-nona2,4-dienal, methyl (E)-3-phenylprop-2-enoate, and 1-octen-3-one or 1-octen-3-ol were essential to the aroma of T. magnivelare. Chiral chromatography showed that a-pinene was a scalemic mixture of 34% (R)-(+) to 66% (S)-(-), while 1-octen-3-ol was present as 95% (R)-(-) to 5% (S)-(+), and linalool was 96% (R)-(-) to 4% (S)-(+). These results establish the base for future investigations into the aroma chemistry of other members of the genus Tricholoma.

Safety of Methyl 3-phenylpropionate. About Methyl 3-phenylpropionate, If you have any questions, you can contact Murray, AF; Moore, AJ; Munafo, JP or concate me.

Reference:
Patent; SANOFI; US2011/294788; (2011); A1;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

What kind of challenge would you like to see in a future of compound:2005-10-9

Name: 6H-Benzo[c]chromen-6-one. About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Shirase, S; Tamaki, S; Shinohara, K; Hirosawa, K; Tsurugi, H; Satoh, T; Mashima, K or concate me.

Recently I am researching about METAL CHARGE-TRANSFER; VISIBLE-LIGHT; PHOTOREDOX CATALYSIS; DEHYDROGENATIVE LACTONIZATION; EFFECTIVE ALKYLATION; GAMMA-LACTONES; PYRIDINE RING; COMPLEXES; FUNCTIONALIZATION; CYCLIZATION, Saw an article supported by the JSPS KAKENHIMinistry of Education, Culture, Sports, Science and Technology, Japan (MEXT)Japan Society for the Promotion of ScienceGrants-in-Aid for Scientific Research (KAKENHI) [JP19H04578, JP18H04267, JP15H05808]. Published in AMER CHEMICAL SOC in WASHINGTON ,Authors: Shirase, S; Tamaki, S; Shinohara, K; Hirosawa, K; Tsurugi, H; Satoh, T; Mashima, K. The CAS is 2005-10-9. Through research, I have a further understanding and discovery of 6H-Benzo[c]chromen-6-one. Name: 6H-Benzo[c]chromen-6-one

We found that in situ generated cerium(IV) carboxylate generated by mixing the precursor Ce((OBu)-Bu-t)(4) with the corresponding carboxylic acids served as efficient photocatalysts for the direct formation of carboxyl radicals from carboxylic acids under blue light-emitting diodes (blue LEDs) irradiation and air, resulting in catalytic decarboxylative oxygenation of aliphatic carboxylic acids to give C-O bond-forming products such as aldehydes and ketones. Control experiments revealed that hexanuclear Ce(IV) carboxylate clusters initially formed in the reaction mixture and the ligand-to-metal charge transfer nature of the Ce(IV) carboxylate clusters was responsible for the high catalytic performance to transform the carboxylate ligands to the carboxyl radical. In addition, the Ce(IV) carboxylate cluster catalyzed direct lactonization of 2-isopropylbenzoic acid to produce the corresponding peroxy lactone and gamma-lactone via intramolecular 1,5-hydrogen atom transfer (1,5-HAT).

Name: 6H-Benzo[c]chromen-6-one. About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Shirase, S; Tamaki, S; Shinohara, K; Hirosawa, K; Tsurugi, H; Satoh, T; Mashima, K or concate me.

Reference:
Article; Zhang, Jian; Shi, Dongdong; Zhang, Haifeng; Xu, Zheng; Bao, Hanyang; Jin, Hongwei; Liu, Yunkui; Tetrahedron; vol. 73; 2; (2017); p. 154 – 163;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

You Should Know Something about C13H8O2

About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Vriza, A; Canaj, AB; Vismara, R; Cook, LJK; Manning, TD; Gaultois, MW; Wood, PA; Kurlin, V; Berry, N; Dyer, MS; Rosseinsky, MJ or concate me.. Product Details of 2005-10-9

An article One class classification as a practical approach for accelerating pi-pi co-crystal discovery WOS:000617028900011 published article about CHARGE-TRANSFER; ORGANIC COCRYSTALS; MOLECULAR-COMPLEX; DESIGN; ANTHRACENE; PYRENE; WILL in [Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Cook, Laurence J. Kershaw; Manning, Troy D.; Gaultois, Michael W.; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Dept Chem, 51 Oxford St, Liverpool L7 3NY, Merseyside, England; [Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Cook, Laurence J. Kershaw; Manning, Troy D.; Gaultois, Michael W.; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Mat Innovat Factory, 51 Oxford St, Liverpool L7 3NY, Merseyside, England; [Vriza, Aikaterini; Gaultois, Michael W.; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Leverhulme Res Ctr Funct Mat Design, Oxford St, Oxford, England; [Wood, Peter A.] Cambridge Crystallog Data Ctr, 12 Union Rd, Cambridge CB2 1EZ, England; [Kurlin, Vitaliy] Univ Liverpool, Dept Comp Sci, Mat Innovat Factory, Liverpool L69 3BX, Merseyside, England in 2021.0, Cited 81.0. Product Details of 2005-10-9. The Name is 6H-Benzo[c]chromen-6-one. Through research, I have a further understanding and discovery of 2005-10-9

The implementation of machine learning models has brought major changes in the decision-making process for materials design. One matter of concern for the data-driven approaches is the lack of negative data from unsuccessful synthetic attempts, which might generate inherently imbalanced datasets. We propose the application of the one-class classification methodology as an effective tool for tackling these limitations on the materials design problems. This is a concept of learning based only on a well-defined class without counter examples. An extensive study on the different one-class classification algorithms is performed until the most appropriate workflow is identified for guiding the discovery of emerging materials belonging to a relatively small class, that being the weakly bound polyaromatic hydrocarbon co-crystals. The two-step approach presented in this study first trains the model using all the known molecular combinations that form this class of co-crystals extracted from the Cambridge Structural Database (1722 molecular combinations), followed by scoring possible yet unknown pairs from the ZINC15 database (21 736 possible molecular combinations). Focusing on the highest-ranking pairs predicted to have higher probability of forming co-crystals, materials discovery can be accelerated by reducing the vast molecular space and directing the synthetic efforts of chemists. Further on, using interpretability techniques a more detailed understanding of the molecular properties causing co-crystallization is sought after. The applicability of the current methodology is demonstrated with the discovery of two novel co-crystals, namely pyrene-6H-benzo[c]chromen-6-one (1) and pyrene-9,10-dicyanoanthracene (2).

About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Vriza, A; Canaj, AB; Vismara, R; Cook, LJK; Manning, TD; Gaultois, MW; Wood, PA; Kurlin, V; Berry, N; Dyer, MS; Rosseinsky, MJ or concate me.. Product Details of 2005-10-9

Reference:
Article; Zhang, Jian; Shi, Dongdong; Zhang, Haifeng; Xu, Zheng; Bao, Hanyang; Jin, Hongwei; Liu, Yunkui; Tetrahedron; vol. 73; 2; (2017); p. 154 – 163;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics