Tag: M.W=150-200

One prominent application of synthetic organobromine compounds is the use of polybrominated diphenyl ethers as fire-retardants, and in fact fire-retardant manufacture is currently the major industrial use of the element bromine. 4897-84-1, formula is C5H9BrO2, Name is Methyl 4-bromobutanoate, Synthetic Route of 4897-84-1

Diaz-Peralta, Lucero;Razo-Hernandez, Rodrigo Said;Pastor, Nina;Santiago, Angel;Guevara-Salazar, Juan Alberto;Fernandez-Zertuche, Mario research published 《 1,4-Disubstituted-1,2,3-triazole GABA Analogues: Synthesis, In-Vitro Evaluation, Quantum QSAR and Molecular Docking against Pseudomonas fluorescens GABA-AT》, the research content is summarized as follows. The synthesis of a new series of γ-aminobutyric acid (GABA) analogs was reported where the nitrogen at the γ-position contained in a 1,4-disubstituted-1,2,3-triazole ring system. The triazole ring system was assembled by the Cu(I)-catalyzed alkyne-azide 1,3-dipolar cycloaddition (CuACC) protocol. Two compounds were identified two active compounds with 43 and 59% inhibition resp. A descriptive quantum QSAR study was carried out to correlate this activity with the structural changes in the GABA scaffold. The inhibitory activity of the compounds was related to the electronic properties of the triazole ring and substituents. The interaction with P. fluorescens GABA-aminotransferase (GABA-AT) was evaluated by mol. docking, using a homol. model of the biol. target. One compound showed the best interaction energy, the thiophene- substituted triazole, with a value that correlates well with the exptl. inhibition results. The triazole ring is determinant for a proper orientation for interaction with the GABA-AT enzyme. In addition, the mol. docking revealed the importance of a hydrophobic pocket near the PLP prosthetic group and how this pocket can be used to improve the inhibitory activity of GABA analogs. Human GABA-AT mol. docking studies of these analogs showed their great potential as competitive inhibitors of this enzyme.

Synthetic Route of 4897-84-1, Methyl 4-bromobutyrate,also as known as 4-Bromobutyric acid methyl ester, is a useful research compound. Its molecular formula is C5H9BrO2 and its molecular weight is 181.03 g/mol. The purity is usually 95%.
4-Bromobutyric acid methyl ester is a synthetic compound that can be used to inhibit the activity of the G1 phase cyclin-dependent kinases. It has been shown to inhibit protein synthesis by alkylating the amino groups of proteins and fatty acids. 4-Bromobutyric acid methyl ester also inhibits the growth of cancer cell lines, such as renal carcinoma cells. The mechanism of action for this drug is not well understood, but it may be due to its ability to bind with monoclonal antibodies and enter kidney cells by passive diffusion., 4897-84-1.

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

Organic bromides such as alkyl bromides are used as fumigants in agriculture to control insects. 5445-17-0, formula is C4H7BrO2, Name is Methyl 2-bromopropanoate. Ethylene bromide is one of the commercially important organic bromides which are the component of leaded gasoline. Category: bromides-buliding-blocks.

Dietrich, Justin D.;Longenecker, Kenton L.;Wilson, Noel S.;Goess, Christian;Panchal, Sanjay C.;Swann, Steven L.;Petros, Andrew M.;Hobson, Adrian D.;Ihle, David;Song, Danying;Richardson, Paul;Comess, Kenneth M.;Cox, Philip B.;Dombrowski, Amanda;Sarris, Kathy;Donnelly-Roberts, Diana L.;Duignan, David B.;Gomtsyan, Arthur;Jung, Paul;Krueger, A. Chris;Mathieu, Suzanne;McClure, Andrea;Stoll, Vincent S.;Wetter, Jill;Mankovich, John A.;Hajduk, Philip J.;Vasudevan, Anil;Stoffel, Robert H.;Sun, Chaohong research published 《 Development of Orally Efficacious Allosteric Inhibitors of TNFα via Fragment-Based Drug Design》, the research content is summarized as follows. Tumor necrosis factor α (TNFα) is a soluble cytokine that is directly involved in systemic inflammation through the regulation of the intracellular NF-κB and MAPK signaling pathways. The development of biol. drugs that inhibit TNFα has led to improved clin. outcomes for patients with rheumatoid arthritis and other chronic autoimmune diseases; however, TNFα has proven to be difficult to drug with small mols. Herein, we present a two-phase, fragment-based drug discovery (FBDD) effort in which we first identified isoquinoline fragments that disrupt TNFα ligand-receptor binding through an allosteric desymmetrization mechanism as observed in high-resolution crystal structures. The second phase of discovery focused on the de novo design and optimization of fragments with improved binding efficiency and drug-like properties. The 3-indolinone-based lead compound 12 (I) presented here displays oral, in vivo efficacy in a mouse glucose-6-phosphate isomerase (GPI)-induced paw swelling model comparable to that seen with a TNFα antibody.

Category: bromides-buliding-blocks, Methyl 2-bromopropionate, also known as Methyl 2-bromopropionate, is a useful research compound. Its molecular formula is C4H7BrO2 and its molecular weight is 167 g/mol. The purity is usually 95%.
Methyl 2-bromopropionate is used in the synthesis of poly(ADP-Ribose)polymerase inhibitors derived from benzoxazin-3-one. Also used in the synthesis of 5-HT2C antagonists affecting serotonin levels.
Methyl 2-bromopropanoate is a chemical compound that can be synthesized in an asymmetric manner. The reaction of methyl 2-bromopropanoate with hydrochloric acid gives the corresponding carboxylic acid, methyl propanoate, and hydrogen bromide in a 1:1 ratio. It has been shown that methyl 2-bromopropanoate is a potential catalyst for the reduction of chloride to chloride ion via the borohydride reduction method. Methyl 2-bromopropanoate has also been used as a model system for studying halides and copper complexes. Magnetic resonance spectroscopy studies have revealed that this chemical compound has a high redox potential and kinetic properties., 5445-17-0.

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

A variety of minor organobromine compounds are found in nature, but none are biosynthesized or required by mammals. 1575-37-7, formula is C6H7BrN2, Name is 4-Bromobenzene-1,2-diamine. Organobromine compounds have fallen under increased scrutiny for their environmental impact., Reference of 1575-37-7.

Ding, Ling;Niu, Kaikai;Liu, Yuxiu;Wang, Qingmin research published 《 Electro-reductive C-H cyanoalkylation of quinoxalin-2(1H)-ones》, the research content is summarized as follows. Herein, authors report a practical electro-reductive protocol for the direct C-H cyanoalkylation of quinoxalin-2(1H)-ones via iminyl radical-mediated ring opening. These mild reactions proceed under metal-, reductant-, and reagent-free conditions to provide synthetically useful cyanoalkylated quinoxalin-2(1H)-ones.

1575-37-7, 4-Bromo-1,2-diaminobenzene can be obtained from 1,2-diaminobenzene via acetylation followed by bromination and alkaline hydrolysis.
4-Bromobenzene-1,2-diamine, also known as 4-Bromobenzene-1,2-diamine, is a useful research compound. Its molecular formula is C6H7BrN2 and its molecular weight is 187.04 g/mol. The purity is usually 95%.
4-Bromo-1,2-diaminobenzene is a dye that is used in diagnostic
procedures to detect the presence of amide groups. 4-Bromo-1,2-diaminobenzene can be used as an inhibitor for cationic polymerization reactions. It also has tuberculostatic activity and inhibits the growth of Mycobacterium tuberculosis. This compound reacts with aniline to form a benzimidazole derivative that contains a reactive amine group. The reaction between this amine group and different electrophiles generates benzimidazole compounds with different properties that are useful in nucleophilic attack reactions. The reaction between 4-bromo-1,2-diaminobenzene and methyl ethyl sulfide produces a luminescent probe that can be used to detect hydrogen bonds., Reference of 1575-37-7

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

Organic compounds having carbon bonded to bromine are called organic bromides. 4897-84-1, formula is C5H9BrO2, Name is Methyl 4-bromobutanoate. Depending on the type of carbon to which the bromine is bonded, organic bromide could be alkyl, alkenyl, alkynyl, or aryl. Synthetic Route of 4897-84-1.

Ding, Xiong;Wang, Pengfei research published 《 Using the 3-Diethylaminobenzyl Group as a Photocage in Aqueous Solution》, the research content is summarized as follows. Authors have demonstrated that the 3-diethylaminobenzyl (DEABn) photolabile protecting group (PPG) is an effective and structurally simple PPG for releasing mols. in aqueous environment. In general, the photoreaction is clean, and the released substrate and the PPG product, i.e., 3-diethylaminobenzyl alc., are obtained in high yield. The clean photoreaction can also be achieved under mild ambient conditions with sunlight, while the reactant is stable under indoor lighting. Release of two substrates from one PPG chromophore in aqueous solution has been demonstrated to be feasible. Authors have also compared the uncaging properties of the DEABn and the widely used o-nitrobenzyl (o-NB) group, given their comparable structural simplicity. With its clean and efficient photochem. reaction, DEABn should find wide applications, including in the basic and applied research areas where o-NB and its various derivatives are widely used.

Synthetic Route of 4897-84-1, Methyl 4-bromobutyrate,also as known as 4-Bromobutyric acid methyl ester, is a useful research compound. Its molecular formula is C5H9BrO2 and its molecular weight is 181.03 g/mol. The purity is usually 95%.
4-Bromobutyric acid methyl ester is a synthetic compound that can be used to inhibit the activity of the G1 phase cyclin-dependent kinases. It has been shown to inhibit protein synthesis by alkylating the amino groups of proteins and fatty acids. 4-Bromobutyric acid methyl ester also inhibits the growth of cancer cell lines, such as renal carcinoma cells. The mechanism of action for this drug is not well understood, but it may be due to its ability to bind with monoclonal antibodies and enter kidney cells by passive diffusion., 4897-84-1.

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

Organic compounds having carbon bonded to bromine are called organic bromides. 6911-87-1, formula is C7H8BrN, Name is 4-Bromo-N-methylaniline. Depending on the type of carbon to which the bromine is bonded, organic bromide could be alkyl, alkenyl, alkynyl, or aryl. COA of Formula: C7H8BrN.

Ding, Yuxin;Kuang, Jinqiang;Xiao, Xuqiong;Wang, Lei;Ma, Yongmin research published 《 Environmentally Benign Synthesis of Quinoline-Spiroquinazolinones by Iron-Catalyzed Dehydrogenative [4 + 2] Cycloaddition of Secondary/Tertiary Anilines and 4-Methylene-quinazolinones》, the research content is summarized as follows. An efficient iron-catalyzed cross-dehydrogenative coupling [4 + 2] annulation of secondary/tertiary anilines with quinazolinones to generate quinoline-spiroquinzolinones I [R¹ = H, 7-Me; R² = n-Pr, 3-ClC₆H₄, Bn, etc.; R³ = H, 6-Br, 7-Me, etc.; X = O, S] was reported. The reaction proceeded smoothly with a relatively broad variety of functional groups, a cheap transition metal catalyst (FeCl₃), and environmentally friendly oxidant (H₂O₂/O₂) under mild reaction conditions. Creatively, N-methylanilines were employed for the first time for the cycloaddition as both Me and methylene sources attached to the N atom of tetrahydroquinolines.

6911-87-1, 4-Bromo-N-methylaniline is a aniline based compound known to exhibit mutagenic properties.
4-Bromo-N-methylaniline is a useful research compound. Its molecular formula is C7H8BrN and its molecular weight is 186.05 g/mol. The purity is usually 95%.
4-Bromophenylmethylamine is an organic compound that has anti-inflammatory properties and is used as a pharmaceutical. It belongs to the group of amines. The hydrolysis of 4-bromophenylmethylamine by hydrochloric acid produces phenol and bromamine (NHBr). The reaction system can be used to synthesize a number of compounds, including anilines, benzofurans, and other aromatic compounds. 4-Bromophenylmethylamine reacts with muscle tissue in a similar manner as acetaminophen does. This drug also has been shown to have significant effects on the energy metabolism in the muscles of rats that are given carbon source., COA of Formula: C7H8BrN

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

One prominent application of synthetic organobromine compounds is the use of polybrominated diphenyl ethers as fire-retardants, and in fact fire-retardant manufacture is currently the major industrial use of the element bromine. 629-04-9, formula is C7H15Br, Name is 1-Bromoheptane, Name: 1-Bromoheptane

Ding, Zhonghua;Chen, Hongjin;Han, Yiying;Liu, Jian research published 《 Molecular engineering of π-extended viologens consisting of quinoxaline-based bridges for tunable electrochromic devices》, the research content is summarized as follows. In this work, four novel π-extended viologens have been developed by introducing quinoxaline-based units for electrochromism. The optical and electrochem. properties of these four π-extended viologens were investigated, which were dependent on the substituents on their π-conjugated bridges. All-in-one electrochromic devices were prepared by using each π-extended viologen as cathode material and ferrocene as anode material, resp. All these four devices exhibited efficient electrochromic performance involving high optical contrast over 80%, and short switching time around 1 s, as well as good coloration efficiency. Among them, device based on HBOV showed a high optical contrast of 82% at 582 nm with bleaching time and coloring time of 0.84 s and 0.68 s, resp., and a coloration efficiency of 334 cm²/C. Moreover, the color of these new type viologens in both bleaching and coloring states can be tuned by varying the substituents on quinoxaline units.

629-04-9, 1-Bromoheptane is a useful research compound. Its molecular formula is C7H15Br and its molecular weight is 179.1 g/mol. The purity is usually 95%.
1-Bromoheptane is a reagent that is used for the preparation of alkylthiophienylzinc chloride.
1-Bromoheptane is a reactive compound that is used in the preparation of p-hydroxybenzoic acid, which is an intermediate in the synthesis of many natural compounds. 1-Bromoheptane has been shown to have biological properties and to inhibit mitochondrial membrane potential. It also causes cell lysis and hepatic steatosis in mice. This compound has been shown to inhibit the activity of enzymes such as acetylcholinesterase, butyrylcholinesterase, and carboxylesterase. 1-Bromoheptane can be used as a model for studying the effects on congestive heart failure by increasing cardiac workloads or decreasing myocardial contractility., Name: 1-Bromoheptane

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

Vinyl bromides undergo the Heck reaction, which involves C-C coupling with alkene to give substituted alkenes. 5445-17-0, formula is C4H7BrO2, Name is Methyl 2-bromopropanoate. Methyl bromide is a precursor in the manufacture of several chemicals and is employed as a soil sterilant, mainly for seed production. Computed Properties of 5445-17-0.

Dittrich, Jonas;Kather, Michael;Holzberger, Anna;Pich, Andrij;Gohlke, Holger research published 《 Cumulative submillisecond all-atom simulations of the temperature-induced coil-to-globule transition of poly(N-vinylcaprolactam) in aqueous solution》, the research content is summarized as follows. Poly(N-vinylcaprolactam) (PNVCL) polymers are stimuli-responsive and change their conformation in aqueous solutions upon changes in salt concentration, concentration of organic solvents, or temperature, making these mols. highly interesting for tailored release of drugs or fabrication of sensors or actuators. At lower critical solution temperature (LCST), PNVCL chains undergo a transition from a coil to a globule and become insoluble In contrast to other polymers, however, PNVCL has received much less attention as to elucidating driving forces of its coil-to-globule transition at an atomistic level. Here, we show by a combined computational and exptl. study that upon temperature increase, PNVCL chains dissolved in water experience an increase of intramol. interactions between C₃ and C₄ of the caprolactam ring. Therefore, more favorable cavity formation energies and the increase of intramol. interactions outweigh the loss in polar and hydrophobic solvation, and the loss of configurational entropy in the coil-to-globule transition and, thus, may be considered driving forces of the polymer’s collapse at LCST. These results are based on mol. dynamics simulations of in total 600μs length and transition (free) energy computations that have been validated internally and against exptl. data. We systematically tested the influence of the polymer’s length, concentration, tacticity, of the thermodn. ensemble, and of the water model. Tacticity was found to be most influential, with atactic polymers showing the strongest tendency to collapse. The presented approach should be applicable to scrutinize at the atomistic level the impact of, for example, ion and polymer dispersity on the coil-to-globule transition of PNVCL, and the LCST behavior of other polymers.

5445-17-0, Methyl 2-bromopropionate, also known as Methyl 2-bromopropionate, is a useful research compound. Its molecular formula is C4H7BrO2 and its molecular weight is 167 g/mol. The purity is usually 95%.
Methyl 2-bromopropionate is used in the synthesis of poly(ADP-Ribose)polymerase inhibitors derived from benzoxazin-3-one. Also used in the synthesis of 5-HT2C antagonists affecting serotonin levels.
Methyl 2-bromopropanoate is a chemical compound that can be synthesized in an asymmetric manner. The reaction of methyl 2-bromopropanoate with hydrochloric acid gives the corresponding carboxylic acid, methyl propanoate, and hydrogen bromide in a 1:1 ratio. It has been shown that methyl 2-bromopropanoate is a potential catalyst for the reduction of chloride to chloride ion via the borohydride reduction method. Methyl 2-bromopropanoate has also been used as a model system for studying halides and copper complexes. Magnetic resonance spectroscopy studies have revealed that this chemical compound has a high redox potential and kinetic properties., Computed Properties of 5445-17-0

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

One prominent application of synthetic organobromine compounds is the use of polybrominated diphenyl ethers as fire-retardants, and in fact fire-retardant manufacture is currently the major industrial use of the element bromine. 4224-70-8, formula is C6H11BrO2, Name is 6-Bromohexanoic acid, Name: 6-Bromohexanoic acid

Divya, R.;Supraja, N.;David, E. research published 《 GC-MS analysis of phyto-chemical constituents in aqueous, methanol and ethyl acetate extracts of Vitis vinifera peel and its characterization studies by using AGNPs》, the research content is summarized as follows. Vitis Vinifera peel (Red) has major components such as Organic acids, Malate, higher moisture content and it is the source of medicine with high antioxidant activity for hundreds of years, Vitis vinifera belongs to family Vitaceae. But in our present work is designed to identify the possible phyto-chems. compounds present in the Aqueous extracts, methanolic extract, and Et acetate extracts of of Vitis vinifera peel by using GC-MS spectrum with their retention times indicating the peaks. This Vitis vinifera peel were shown nearly Thirty to Forty compounds from the Aqueous, Methanol and Et acetate extracts the major chem. compounds were Xylose, Cyclo-hexanidiol, Octane, Butanoic acids and Octa -deca-diyndioic acids etc and from the Aqueous extracts we synthesized the AgNPs for preliminary characterization studies such as UV, DLS and SEM anal.

Name: 6-Bromohexanoic acid, 6-bromohexanoic acid is an organobromine compound comprising hexanoic acid having a bromo substituent at the 6-position. It derives from a hexanoic acid.
6-Bromohexanoic acid is a useful research compound. Its molecular formula is C6H11BrO2 and its molecular weight is 195.05 g/mol. The purity is usually 95%.
6-Bromohexanoic acid is useful for the preparation of anti-CTLA4 compounds as antitumor agents.
6-Bromohexanoic acid is a fatty acid that has been shown to be an effective agent for the treatment of cancer. It is used in gene therapy to inhibit the growth of cancer cells by binding to and then activating transcription factors. 6-Bromohexanoic acid can also be used as a chemotherapeutic agent and has been shown to cause apoptosis in monoclonal antibody-treated cells. 6-Bromohexanoic acid has pharmacokinetic properties that are similar to those of other fatty acids. The reaction solution was found to have high chemical stability, which may be due to the presence of nitrogen atoms. This reaction solution was found to adsorb onto the surface of monoclonal antibodies and cell culture, altering their properties., 4224-70-8.

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

One prominent application of synthetic organobromine compounds is the use of polybrominated diphenyl ethers as fire-retardants, and in fact fire-retardant manufacture is currently the major industrial use of the element bromine. 6911-87-1, formula is C7H8BrN, Name is 4-Bromo-N-methylaniline, Related Products of 6911-87-1

Dobah, Farhaan;Mazodze, C. Munashe;Petersen, Wade F. research published 《 Cross-Dehydrogenative Cyclization-Dimerization Cascade Sequence for the Synthesis of Symmetrical 3,3′-Bisoxindoles》, the research content is summarized as follows. The synthesis of sym. 3,3′-bisoxindoles from simple acyclic β-oxoanilides were reported. The described method forged three new C-C bonds in a single step via a sequential Mn(OAc)₃·2H₂O mediated oxidative radical cyclization-fragmentation-dimerization process. The scope of this reaction was demonstrated in the preparation of a variety of 3,3′-bisoxindoles, as well as its application toward the formal synthesis of the Calycanthaceae alkaloid, (±)-folicanthine.

6911-87-1, 4-Bromo-N-methylaniline is a aniline based compound known to exhibit mutagenic properties.
4-Bromo-N-methylaniline is a useful research compound. Its molecular formula is C7H8BrN and its molecular weight is 186.05 g/mol. The purity is usually 95%.
4-Bromophenylmethylamine is an organic compound that has anti-inflammatory properties and is used as a pharmaceutical. It belongs to the group of amines. The hydrolysis of 4-bromophenylmethylamine by hydrochloric acid produces phenol and bromamine (NHBr). The reaction system can be used to synthesize a number of compounds, including anilines, benzofurans, and other aromatic compounds. 4-Bromophenylmethylamine reacts with muscle tissue in a similar manner as acetaminophen does. This drug also has been shown to have significant effects on the energy metabolism in the muscles of rats that are given carbon source., Related Products of 6911-87-1

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary

One prominent application of synthetic organobromine compounds is the use of polybrominated diphenyl ethers as fire-retardants, and in fact fire-retardant manufacture is currently the major industrial use of the element bromine. 629-04-9, formula is C7H15Br, Name is 1-Bromoheptane, Category: bromides-buliding-blocks

Domanski, Michal;Zurauskas, Jonas;Barham, Joshua P. research published 《 Tunable Microwave Flow System for Scalable Synthesis of Alkyl Imidazolium-type Ionic Liquids》, the research content is summarized as follows. A continuous flow auto-frequency tuning single-mode microwave reactor is disclosed as a powerful platform to synthesize alkyl imidazolium salts, e.g., I and II, as ionic liquids/ionic liquid precursors in up to near-quant. yields, 100-600 g h^-1 productivities with record space-time yields. Challenges faced, including viscosity changes, dielec. property changes, and phase separation, were addressed by different operation modes of the reactor without reactor redesigning. Depending on the purpose, this highly productive method could prove to be useful for intensive applications of ionic liquids

Category: bromides-buliding-blocks, 1-Bromoheptane is a useful research compound. Its molecular formula is C7H15Br and its molecular weight is 179.1 g/mol. The purity is usually 95%.
1-Bromoheptane is a reagent that is used for the preparation of alkylthiophienylzinc chloride.
1-Bromoheptane is a reactive compound that is used in the preparation of p-hydroxybenzoic acid, which is an intermediate in the synthesis of many natural compounds. 1-Bromoheptane has been shown to have biological properties and to inhibit mitochondrial membrane potential. It also causes cell lysis and hepatic steatosis in mice. This compound has been shown to inhibit the activity of enzymes such as acetylcholinesterase, butyrylcholinesterase, and carboxylesterase. 1-Bromoheptane can be used as a model for studying the effects on congestive heart failure by increasing cardiac workloads or decreasing myocardial contractility., 629-04-9.

Referemce:
Bromide – Wikipedia,
bromide – Wiktionary