Tag: 100-200

《General Route to Purin-2-ylmagnesium Halides by Metal-Halogen Exchange in Dichloromethane》 was written by Gazzola, Silvia; Gordon, Malcolm R.; Lindell, Stephen D.. Product Details of 60656-87-3 And the article was included in Synlett in 2020. The article conveys some information:

Treatment of a solution of 2-iodopurines in dichloromethane with an ethereal solution of ethylmagnesium bromide at -5°C generated the corresponding purin-2-ylmagnesium bromide, which reacted with aldehydes to give the corresponding 2-(hydroxyalkyl)purines I [R1 = H, Cl; R2 = i-Pr, 4-MeC6H4; R3 = Ph, 2-furyl, CH2OBn, etc.] in 53-84% yield. Performing the same procedure in THF as solvent resulted either in extensive decomposition or rapid isomerization to give 8-(hydroxyalkyl)purine. In the experimental materials used by the author, we found 2-(Benzyloxy)acetaldehyde(cas: 60656-87-3Product Details of 60656-87-3)

2-(Benzyloxy)acetaldehyde(cas: 60656-87-3) is a non-natural aldehyde. It undergoes enantioselective Mukaiyama aldol reaction with silylketene acetal nucleophiles in the presence of C2-symmetric bis(oxazolinyl)pyridine Cu(II) complex (catalyst).Product Details of 60656-87-3

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《Cyanide chemosensors based on 3-dicyanovinylpyrazolo[1,5-a]pyrimidines: Effects of peripheral 4-anisyl group substitution on the photophysical properties》 was published in Talanta in 2020. These research results belong to Tigreros, Alexis; Castillo, Juan-Carlos; Portilla, Jaime. Related Products of 4637-24-5 The article mentions the following:

Novel dual-mode colorimetric/fluorometric probes based on 3-dicyanovinylpyrazolo[1,5-a]pyrimidines for cyanide (CN-) sensing have been developed (DPPa-c). These probes displayed high selectivity and sensitivity toward CN- over other interfering anions, with a detection limit (LOD) as low as 610/170 nmol L-1 (absorption/emission) for some of the prepared probes. After a reaction with CN-, low-fluorescent DPPa-c showed a significant decrease of the intramol. charge transfer (ICT) bands at approx. 390 nm (color changes from yellow to colorless) and exhibited up to an 82-fold fluorescence enhancement at approx. 465 nm (strong blue-light emission). The successive introduction of 4-anisyl (4-MeOPh) groups on periphery of the heterocyclic core had a dramatic influence on both the photophys. properties and CN- detection capability. The number of channels for CN- quantification in the absorption spectra increased from 1 in DPPa to 3 in DPPc. Moreover, the fluorescence emission LOD decreased from 300 nmol L-1 in DPPa to 170 nmol L-1 in DPPc. Finally, the selectivity toward CN- demonstrated a notable improvement when the probe had three 4-anisyl groups in its periphery (i.e., DPPc). The experimental part of the paper was very detailed, including the reaction process of N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5Related Products of 4637-24-5)

N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5) belongs to anime. The methylamines occur in small amounts in some plants. Many polyfunctional amines (i.e., those having other functional groups in the molecule) occur as alkaloids in plants—for example, mescaline, 2-(3,4,5-trimethoxyphenyl)ethylamine; the cyclic amines nicotine, atropine, morphine, and cocaine; and the quaternary salt choline, N-(2-hydroxyethyl)trimethylammonium chloride, which is present in nerve synapses and in plant and animal cells.Related Products of 4637-24-5

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The author of 《Integrated pyrazolo[1,5-a]pyrimidine-hemicyanine system as a colorimetric and fluorometric chemosensor for cyanide recognition in water》 were Tigreros, Alexis; Rosero, Hernan-Alejandro; Castillo, Juan-Carlos; Portilla, Jaime. And the article was published in Talanta in 2019. Computed Properties of C5H13NO2 The author mentioned the following in the article:

A new probe for cyanide detection based on the integrated pyrazolo[1,5-a]pyrimidine-hemicyanine (PpHe) system was synthesized in an efficient and straightforward manner using microwave-assisted heating. Photophys. studies in a 100% aqueous solution demonstrated high cyanide selectivity and detection limits as low as 600 and 86 nmol/L for UV-vis absorption and fluorescence emission, resp. Both values are <<1900 nmol/L, which is the maximum concentration permitted for drinking water by the WHO. HRMS anal. and NMR experiments were performed to confirm the mechanism of detection based on blocking the ICT phenomenon via nucleophilic addition of CN- on the C=N+ bond (iminium salt moiety) of the probe. In addition to this study using N,N-Dimethylformamide Dimethyl Acetal, there are many other studies that have used N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5Computed Properties of C5H13NO2) was used in this study.

N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5) belongs to anime. Left-handed and right-handed forms (mirror-image configurations, known as optical isomers or enantiomers) are possible when all the substituents on the central nitrogen atom are different (i.e., the nitrogen is chiral). With amines, there is extremely rapid inversion in which the two configurations are interconverted.Computed Properties of C5H13NO2

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In 2019,Tetrahedron included an article by Yahaya, Issah; Seferoglu, Nurgul; Seferoglu, Zeynel. Reference of 2-Hydroxy-4-methoxybenzaldehyde. The article was titled 《Improved one-pot synthetic conditions for synthesis of functionalized fluorescent coumarin-thiophene hybrids: Syntheses, DFT studies, photophysical and thermal properties》. The information in the text is summarized as follows:

We have synthesized coumarin-thiophene hybrids using stepwise and one-pot methods under MWI and CM conditions, and then report the findings and conclusions: one-pot is better than stepwise in terms of high yields and fastness of getting products, and MWI (microwave irradiation) is better than CM (conventional method) in terms of purity of compounds, better yields, and reaction period. Even though both protocols were found to be efficient, the microwave-assisted irradiation reactions were identified to be better, environmentally friendly, cost-effective, mild, more efficient, less time consuming but with high purity. The two protocols were employed for the synthesis of the target coumarin-thiophene hybrids via the Gewald reaction in stepwise and in one-pot three-component. The dyes were prepared in good to excellent yields. Although, we recorded better yields via the stepwise protocol (80-96%), for the synthesis of the target mols., as compared to the one-pot (82-90%), the stepwise condition is fraught with many changes such as long reaction conditions, extra use of solvents for purification of intermediates, and long reaction durations. Photophys. activities of all the target derivatives were investigated using a combination of UV-vis and fluorescence spectroscopies in different solvents. The umbelliferon-like derivative 3g (I) was further investigated for possible use as a pH sensor via deprotonation (using TBAOH) and reverse protonation (using TFA), and was found to be applicable as pH sensor both in organic medium (DMSO) and partial aqueous binary (DMSO/H2O, volume/volume, 9:1) medium. Again, the ground and the excited state properties of the umbelliferon-like derivative 3g and its deprotonated form were also studied using the quantum chem. calculations Finally, the thermal properties of all the target compounds were investigated using TGA in order to test their potency and applicability as optical dyes. All the dyes 3a-j have high thermal stability therefore they can be applicable as optical dyes. The experimental part of the paper was very detailed, including the reaction process of 2-Hydroxy-4-methoxybenzaldehyde(cas: 673-22-3Reference of 2-Hydroxy-4-methoxybenzaldehyde)

2-Hydroxy-4-methoxybenzaldehyde(cas: 673-22-3) is employed in the synthesis of Schiff base ligand. It is applied as a reactant in the synthesis of LPA1R antagonists used in the inhibition of LPA-induced proliferation and contraction of normal human lung fibroblasts. Also used in the synthesis of tyrosine kinase 6 proteinase inhibitors.Reference of 2-Hydroxy-4-methoxybenzaldehyde

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The author of 《A novel fluorescence probe based on p-acid-Br and its application in thiourea detection》 were Wang, Xiu; Yang, Chunlei; Yan, Mei; Ge, Shenguang; Yu, Jinghua. And the article was published in RSC Advances in 2016. Reference of 1,4-Diethynyl-2,5-dimethoxybenzene The author mentioned the following in the article:

In this paper, a novel phenyleneethynylene derivative 4,4′-(2,5-dimethoxy-1,4-phenylene)bis(ethyne-2,1-diyl) dibenzoic acid (p-acid) and its derivative p-acid-Br were synthesized. IR spectroscopy (IR), fluorescence (FL) spectroscopy and UV visible (UV-vis) spectroscopy were applied to characterize p-acid and p-acid-Br. To research the practical applicability, a sample thiourea sensor was constructed using the p-acid-Br label, in which the FL intensity response was proportional to the thiourea concentration in the range of 0.5-1000 nM, with a detection limit of 0.26 nM. Furthermore, the sensor showed high specificity, excellent stability, and good reproducibility. The p-acid-Br-based thiourea sensor can also provide potential application for detection of other organics The method showed low detection limit, good specificity, high sensitivity and reproducibility. Satisfactory results were obtained for the determination of thiourea in various water samples and fruit juice samples. This work is to open new avenues in the application of the phenyleneethynylene derivative for a sensitive thiourea assay. Hence, the proposed fluorescence sensor could become a promising method for local market. In the experiment, the researchers used many compounds, for example, 1,4-Diethynyl-2,5-dimethoxybenzene(cas: 74029-40-6Reference of 1,4-Diethynyl-2,5-dimethoxybenzene)

1,4-Diethynyl-2,5-dimethoxybenzene(cas: 74029-40-6) belongs to ethers.The C-O bonds that comprise simple ethers are strong. They are unreactive toward all but the strongest bases. Although generally of low chemical reactivity, they are more reactive than alkanes. Reference of 1,4-Diethynyl-2,5-dimethoxybenzene

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HPLC of Formula: 74029-40-6On October 12, 2016 ,《Tuning the backbones and side chains of cationic meta-linked poly(phenylene ethynylene)s: Different conformational modes, tunable light emission, and helical wrapping of multi-walled carbon nanotubes》 was published in Polymer. The article was written by Huang, Yan-Qin; Zhong, Yi-You; Zhang, Rui; Zhao, Yong-Kang; Liu, Xing-Fen; Zhang, Guang-Wei; Fan, Qu-Li; Wang, Lian-Hui; Huang, Wei. The article contains the following contents:

We have an ongoing interest in the design and control of helical conformation of water-soluble meta-linked poly(phenylene ethynylene)s (PPEs) and the further development of novel functional materials. Four cationic meta-linked PPEs (P1′-P4′) were synthesized to study the influence of differences in the backbone and side chain structure on their conformations. For P1′ and P4′ without side chains on the para-phenylene units, fluorescence spectroscopic investigations indicated obvious intramol. helical folding, whereas for P2′ and P3′ with nonpolar and polar side chains on the para-phenylene units resp., a significantly different conformational mode, namely, cofacial intermol. aggregation was suggested. The side chains on the para-phenylene units of P2′ and P3′ may be located in the interior cavity of helix and induce steric effect on the formation of helix. However, the introduction of 2,1,3-benzothiadiazole (BT), a low energy gap unit, into the backbone of P4′ showed little influence on the formation of helix despite its larger and more rigid structure than the phenylene unit. Thus, the light emission of these polymers can be tuned in the range from blue, green to yellow with the changes of conformational modes. Moreover, the functionalization of multi-walled carbon nanotubes (MWCNTs) by P4′ in methanol and water, and by using its neutral precursory polymer P4 in THF was explored through transmission electron microscopy and fluorescence spectroscopy. P4′ was directly observed to individualize MWCNT by forming a monolayer helical wrapping on the nanotube surface, which may be attributed to the backbone flexibility of meta-linked PPE and the strong π-π interactions between the PPE backbone and the CNT surface. Moreover, P4′ served as a better dispersing agent for MWCNT than P4, suggesting that the cationic side groups may act as solubilizing groups which also separated the individual nanotubes because of charge repulsion.1,4-Diethynyl-2,5-dimethoxybenzene(cas: 74029-40-6HPLC of Formula: 74029-40-6) was used in this study.

1,4-Diethynyl-2,5-dimethoxybenzene(cas: 74029-40-6) belongs to ethers.Oxygen is more electronegative than carbon, thus the alpha hydrogens of ethers are more acidic than those of simple hydrocarbons. They are far less acidic than alpha hydrogens of carbonyl groups (such as in ketones or aldehydes), however. HPLC of Formula: 74029-40-6

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《New Synthetic Route to Tucatinib》 was written by Yin, Lingfeng; Mao, Yongjun; Liu, Yaowei; Bu, Lehao; Zhang, Long; Chen, Wenxin. SDS of cas: 4637-24-5This research focused ontucatinib preparation. The article conveys some information:

A new and improved synthetic route to tucatinib was described that involves three key intermediates. The first of these, 4-([1,2,4]triazolo[1,5- a]pyridin-7-yloxy)-3-methylaniline was prepared on a 100 g scale in 33% yield over five steps and 99% purity. Next, N4-(4-([1,2,4]triazolo[1,5-a]pyridin-7-yloxy)-3-methylphenyl)quinazoline-4,6-diamine was isolated in 67% yield over three steps and >99% purity. Then, 4,4-dimethyl-2-(methylthio)-4,5-dihydrooxazole trifluoromethanesulfonate was prepared under mild conditions in 67% yield over two steps. Finally, tucatinib was obtained in 17% yield over nine steps and in >99% purity (HPLC). Purification methods used to isolate the product and the intermediates involved in the route were also reported. After reading the article, we found that the author used N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5SDS of cas: 4637-24-5)

N,N-Dimethylformamide Dimethyl Acetal(cas: 4637-24-5) belongs to anime. Hydrogen peroxide (H2O2) and peroxy acids generally add an oxygen atom to the nitrogen of amines. With primary amines, this step is normally followed by further oxidation, leading to nitroso compounds, RNO, or nitro compounds, RNO2. Secondary amines are converted to hydroxylamines, R2NOH, and tertiary amines to amine oxides, R3NO.SDS of cas: 4637-24-5

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In 2022,Marrot, Laetitia; Meile, Kristine; Zouari, Mariem; DeVallance, David; Sandak, Anna; Herrera, Rene published an article in Molecules. The title of the article was 《Characterization of the compounds released in the gaseous waste stream during the slow pyrolysis of hemp (Cannabis sativa L.)》.Category: ethers-buliding-blocks The author mentioned the following in the article:

This study aims to characterize and valorize hemp residual biomass by a slow pyrolysis process. The volatile byproducts of hemp carbonization were characterized by several methods (TGA, UV-VIS, TLC, Flash Prep-LC, UHPLC, QTOF-MS) to understand the pyrolysis reaction mechanisms and to identify the chem. products produced during the process. The obtained carbon yield was 29%, generating a gaseous stream composed of phenols and furans which was collected in four temperature ranges (F1 at 20-150°C, F2 at 150-250°C, F3 at 250-400°C and F4 at 400-1000°C). The obtained liquid fractions were separated into subfractions by flash chromatog. The total phenolic content (TPC) varied depending on the fraction but did not correlate with an increase in temperature or with a decrease in pH value. Compounds present in fractions F1, F3 and F4, being mainly phenolic mols. such as guaiacyl or syringyl derivatives issued from the lignin degradation, exhibit antioxidant capacity. The temperature of the pyrolysis process was pos. correlated with detectable phenolic content, which can be explained by the decomposition order of the hemp chem. constituents. A detailed understanding of the chem. composition of pyrolysis products of hemp residuals allows for an assessment of their potential valorization routes and the future economic potential of underutilized biomass.m-Methoxyphenol(cas: 150-19-6Category: ethers-buliding-blocks) was used in this study.

m-Methoxyphenol(cas: 150-19-6) may be used in synthesis of:C(4) symmetric calix[4]resorcinarene, 2-nitroso-5-methoxyphenol, 6-methoxy-2(3H)-benzoxazoloneCategory: ethers-buliding-blocks

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Li, Wenwei; Zhou, Honggui; He, Yequan; Zeng, Ge; Zheng, Yumeng; Hu, Yangni; Chen, Zhongyan; Ge, Jing-Yuan; Lv, Ningning; Chen, Jiuxi published an article in 2022. The article was titled 《Synthesis of Diverse γ-Lactams via Rh-Catalyzed C(sp2)-H Addition to Aliphatic Nitriles》, and you may find the article in Organic Letters.Quality Control of m-Methoxyphenol The information in the text is summarized as follows:

An unprecedented pathway to access γ-lactams I [R1 = H, 6-Me, 5-Ph, etc.; R2 = Ph, 4-MeC6H4, 3-MeOC6H4, etc.], II [R3 = H, 5-F, 5-MeO, 5-N(CH3)2; R4 = Ph, 4-MeC6H4, Bn, etc.] and III [R5 = Me, 4-MeC6H4, 3-MeOC6H4, etc.; R6 = Me, Ph, Bn, etc.] using acetonitrile analogs as coupling partners without oxidants, ligands, and Lewis acids was reported. The reaction undergoes Rh-catalyzed C(sp2)-H addition to carbon-bound nitriles with the aid of an amide traceless auxiliary followed by an annulation sequence, featuring a broad substrate scope, good functional group tolerance, and excellent chemo/stereoselectivity. Scale-up reactions and late-stage derivatizations highlighted the potential synthetic utility of this methodol. A plausible mechanism was proposed based on mechanistic investigations. The results came from multiple reactions, including the reaction of m-Methoxyphenol(cas: 150-19-6Quality Control of m-Methoxyphenol)

m-Methoxyphenol(cas: 150-19-6) may be used in synthesis of:C(4) symmetric calix[4]resorcinarene, 2-nitroso-5-methoxyphenol, 6-methoxy-2(3H)-benzoxazoloneQuality Control of m-Methoxyphenol

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Younes, Maged; Aquilina, Gabriele; Castle, Laurence; Engel, Karl-Heinz; Fowler, Paul; Frutos Fernandez, Maria Jose; Fuerst, Peter; Guertler, Rainer; Gundert-Remy, Ursula; Husoey, Trine; Manco, Melania; Moldeus, Peter; Passamonti, Sabina; Shah, Romina; Waalkens-Berendsen, Ine; Wolfle, Detlef; Wright, Matthew; Benigni, Romualdo; Chipman, Kevin; Cordelli, Eugenia; Degen, Gisela; Carfi, Maria; Vianello, Giorgia; Mennes, Wim published an article in 2021. The article was titled 《Scientific opinion on flavoring group evaluation 414 (FGE .414): 2-hydroxy-4-methoxybenzaldehyde》, and you may find the article in EFSA Journal.Product Details of 673-22-3 The information in the text is summarized as follows:

The EFSA Panel on Food Additives and Flavorings (FAF) was requested to evaluate the safety of the substance 2-hydroxy-4-methoxybenzaldehyde [FL -no: 05.229] as a new flavoring substance, in accordance with Regulation (EC) No 1331/2008. 2-Hydroxy-4-methoxybenzaldehyde belongs to chem. group 23 (Commission Regulation (EC) No 1565/2000) and is structurally related to the hydroxy- and alkoxy-ring substituted benzyl derivatives evaluated in FGE .52 and in FGE .20Rev4. The Panel considered the structural/metabolic similarity sufficient to evaluate the candidate substance following a group-based approach according to the EFSA Guidance on the data required for the risk assessment of flavorings to be used in or on foods. The information provided on the manufacturing process, the composition and the stability of [FL -no: 05.229] was considered sufficient. From studies carried out with this substance, the Panel concluded that there is no concern with respect to genotoxicity. Based on QSAR evaluation of possible metabolism, and based on information from structurally related substances, various metabolic routes can be anticipated, which only result in the formation of innocuous metabolites. The exposure estimates for [FL -no: 05.229] (24 and 60 μg/person per day for children and adults, resp.) were below the Threshold of Toxicol. Concern (TTC) for its structural class (I). Accordingly, toxicity studies are not required and the Panel concluded at step A3 of the Procedure that 2-hydroxy-4-methoxybenzaldehyde is not of safety concern when used as a flavoring substance at the intended uses and use levels. Cumulative exposure estimates for 2-hydroxy-4-methoxybenzaldehyde and three structurally related substances (2.4 and 6.2 mg/kg body weight (bw) per day for adults and children, resp.) are above the TTC for structural class I, but below the ADI (acceptable daily intake) of 0-10 mg/kg bw per day for vanillin, which is one of these structurally related substances. Therefore, the cumulative exposure to these four substances [FL -no: 05.015, 05.018, 05.229 and 09.749] also does not raise a safety concern. After reading the article, we found that the author used 2-Hydroxy-4-methoxybenzaldehyde(cas: 673-22-3Product Details of 673-22-3)

2-Hydroxy-4-methoxybenzaldehyde(cas: 673-22-3) is the main component of root bark essential oil of Periploca sepium Bunge. It is a potential tyrosinase inhibitor present in African medicinal plants. 2-Hydroxy-4-methoxybenzaldehyde was used in the synthesis of Schiff base ligand.Product Details of 673-22-3

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