Category: 2199-44-2

In general, if the atoms that make up the ring contain heteroatoms, such rings become heterocycles, and organic compounds containing heterocycles are called heterocyclic compounds. An article called Free energy relationships of ionization energies measured by ultraviolet photoelectron spectroscopy in substituted pyrroles, published in 1981-04-30, which mentions a compound: 2199-44-2, Name is Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate, Molecular C9H13NO2, SDS of cas: 2199-44-2.

The ionization energies of six 5-substituted-3-ethoxycarbonyl-2,4-dimethylpyrroles and seven 4-substituted 2-ethoxycarbonyl-3,5-dimethylpyrroles were determined by UPS. The relations between the lowest ionization potentials and σ were determined and the different influence of substituents in the α- and β-positions is discussed.

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Heterocyclic compounds can be divided into two categories: alicyclic heterocycles and aromatic heterocycles. Compounds whose heterocycles in the molecular skeleton cannot reflect aromaticity are called alicyclic heterocyclic compounds. Compound: 2199-44-2, is researched, Molecular C9H13NO2, about Synthesis of novel tetrapyrroles and their zinc complexes, the main research direction is tetrapyrrole preparation complexation zinc; zinc tetrapyrrole complex preparation.Quality Control of Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate.

2,2′-Tetramethyl-5,5′-bis(ethoxycarbonyl)-3,3′-dipyrromethane, prepared from 3,5-dimethyl-2-ethoxycarbonyl-1H-pyrrole and paraformaldehyde, was converted to the dicarboxylic acid and subsequently to the dialdehyde which was reacted with tert-butoxy 4-ethyl-3,5-dimethylpyrazole-2-carboxylate/3,4-diethyl-5-methylpyrazole-2-carboxylic acid/3,5-dimethyl-4-methoxycarbonylethylpyrrole-2-carboxylic acid to give I.2HBr (R = Me, R1 = Et or R = R1 = Et or R = Me, R1 = CH2CH2COOMe). I (R = Me, R1 = Et or CH2CH2COOMe) (HL) reacted with Zn(OAc)2 to give ZnL2.

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The chemical properties of alicyclic heterocycles are similar to those of the corresponding chain compounds. Compound: Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate, is researched, Molecular C9H13NO2, CAS is 2199-44-2, about Detection and Prevention of Aggregation-based False Positives in STD-NMR-based Fragment Screening, the main research direction is fragment screening saturation transfer difference NMR ketopantoate reductase.Recommanded Product: 2199-44-2.

Aggregation of small organic compounds is a problem encountered in a variety of assay screening formats where it often results in detection of false positives. A saturation transfer difference-NMR-detected screen of a com. available fragment library, followed by biochem. assay, identified several inhibitors of the enzyme ketopantoate reductase. These inhibitors were subsequently revealed to be aggregation-based false positives. Modification of the fragment screen by addition of detergent in the saturation transfer difference-NMR experiments allowed an assay format to be developed that resulted in the identification of genuine hit mols. suitable for further development.

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The reaction of an aromatic heterocycle with a proton is called a protonation. One of articles about this theory is 《Molecular compounds of pyrroles》. Authors are Dezelic, Mladen.The article about the compound:Ethyl 3,5-Dimethyl-2-pyrrolecarboxylatecas:2199-44-2,SMILESS:O=C(C1=C(C)C=C(C)N1)OCC).COA of Formula: C9H13NO2. Through the article, more information about this compound (cas:2199-44-2) is conveyed.

The following data were obtained by means of f.-p. determinations In each case the eutectic point is given in mole % of the 2nd component; T. P. = transition point. 2,4-Dimethyl-3-acetyl-5-carbethoxypyrrole (I): AcOH, no solid compound; succinic acid (II), 25%, 126.5°; BzCH (III), 63% 87.5°; ClCH2CO2H (IV), 91%, 52° (T. P., 55%, 85.3°); PhOH (V), 90%, 27° (T. P. 55%, 93°), salicylic acid (VI), 58%, 106° (2 T. P., 38%, 113°, and 50%, 107°); therefore 2 compounds 2I.VI and I.VI; picric acid (VII), 60%, 94° (T. P., 50%, 97.8°); o-C6H4(OH)2 (VIII), 57%, 71° (T. P., 41%, 108.5°); m-C6H4(OH)2 (IX), 2 eutectics, 19%, 132.5°, and 78%, 44° (maximum at 33.3% and 139°); p-C6H4-(OH)2 (X), 2 eutectics, 10%, 138.2° and 62%, 135° (maximum at 33.3%, 153°). 2,4-Dimethyl-5-carbethoxypyrrole (XI): IV, 80%, 49°; V, 86%, 23°; VI, 40%, 94.5°; VIII, 66%, 71°; IX, 56.5%, 74.5°; X, 32%, 106°; VII, 66%, 94° (T. P., 33.3%, 100°; compound, 2XI.VII). 2,4-Dimethyl-5-carbethoxypyrrole-3-aldehyde (XII): IV, 86%, 51° (T. P., 60%, 74.5°; compound, XII.IV); III, maximum at 50% and 135°, 2 eutectics; VII, 60%, 95.5° (T. P., 50%, 97°); VIII forms the compound XII.VIII, m. 114° (2 eutectics); X forms the compound 2XII.X, m. 142° (2 eutectics). 2,5-Dimethyl-3-carbethoxypyrrole-4-aldehyde (XIII):VIII, 67%, 56°; IX, 61%, 80°, compound XIII.IX, m. 98°; compound XIII.X, m. 117.5°; VI forms 2 compounds, 2XIII.VI, and XIII.VI, eutectics 42%, 109° and 57.5%, 109° (T. P., 36%, 111°).

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So far, in addition to halogen atoms, other non-metallic atoms can become part of the aromatic heterocycle, and the target ring system is still aromatic.Thompson, Alison; Gao, Susan; Modzelewska, Gosia; Hughes, David S.; Patrick, Brian; Dolphin, David researched the compound: Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate( cas:2199-44-2 ).Computed Properties of C9H13NO2.They published the article 《x-ray Crystallographic and 13C NMR Investigations of the Effects of Electron-Withdrawing Groups on a Series of Pyrroles》 about this compound( cas:2199-44-2 ) in Organic Letters. Keywords: crystallog carbon NMR electron withdrawing group pyrrole derivative. We’ll tell you more about this compound (cas:2199-44-2).

Pyrroles substituted with various electron-withdrawing groups (EWGs) on the N atom were synthesized and full characterization including x-ray crystal structures obtained. Anal. of 13C chem. shifts and x-ray crystal structures reveals that a trend between decreased aromaticity and the strength of the EWG exists. Exptl. results regarding alternative mechanisms of nucleophilic substitution reactions can thus be rationalized.

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The reaction of an aromatic heterocycle with a proton is called a protonation. One of articles about this theory is 《Molecular compounds of pyrroles》. Authors are Dezelic, Mladen.The article about the compound:Ethyl 3,5-Dimethyl-2-pyrrolecarboxylatecas:2199-44-2,SMILESS:O=C(C1=C(C)C=C(C)N1)OCC).Quality Control of Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate. Through the article, more information about this compound (cas:2199-44-2) is conveyed.

The following data were obtained by means of f.-p. determinations In each case the eutectic point is given in mole % of the 2nd component; T. P. = transition point. 2,4-Dimethyl-3-acetyl-5-carbethoxypyrrole (I): AcOH, no solid compound; succinic acid (II), 25%, 126.5°; BzCH (III), 63% 87.5°; ClCH2CO2H (IV), 91%, 52° (T. P., 55%, 85.3°); PhOH (V), 90%, 27° (T. P. 55%, 93°), salicylic acid (VI), 58%, 106° (2 T. P., 38%, 113°, and 50%, 107°); therefore 2 compounds 2I.VI and I.VI; picric acid (VII), 60%, 94° (T. P., 50%, 97.8°); o-C6H4(OH)2 (VIII), 57%, 71° (T. P., 41%, 108.5°); m-C6H4(OH)2 (IX), 2 eutectics, 19%, 132.5°, and 78%, 44° (maximum at 33.3% and 139°); p-C6H4-(OH)2 (X), 2 eutectics, 10%, 138.2° and 62%, 135° (maximum at 33.3%, 153°). 2,4-Dimethyl-5-carbethoxypyrrole (XI): IV, 80%, 49°; V, 86%, 23°; VI, 40%, 94.5°; VIII, 66%, 71°; IX, 56.5%, 74.5°; X, 32%, 106°; VII, 66%, 94° (T. P., 33.3%, 100°; compound, 2XI.VII). 2,4-Dimethyl-5-carbethoxypyrrole-3-aldehyde (XII): IV, 86%, 51° (T. P., 60%, 74.5°; compound, XII.IV); III, maximum at 50% and 135°, 2 eutectics; VII, 60%, 95.5° (T. P., 50%, 97°); VIII forms the compound XII.VIII, m. 114° (2 eutectics); X forms the compound 2XII.X, m. 142° (2 eutectics). 2,5-Dimethyl-3-carbethoxypyrrole-4-aldehyde (XIII):VIII, 67%, 56°; IX, 61%, 80°, compound XIII.IX, m. 98°; compound XIII.X, m. 117.5°; VI forms 2 compounds, 2XIII.VI, and XIII.VI, eutectics 42%, 109° and 57.5%, 109° (T. P., 36%, 111°).

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So far, in addition to halogen atoms, other non-metallic atoms can become part of the aromatic heterocycle, and the target ring system is still aromatic.Berezin, M. B.; Semeikin, A. S.; Yutanova, S. L.; Antina, E. V.; Guseva, G. B.; V’yugin, A. I. researched the compound: Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate( cas:2199-44-2 ).Electric Literature of C9H13NO2.They published the article 《Synthesis and properties of (1,2,3,7,9-pentamethyldipyrrolylmethen-8-yl)-(1,2,3,7,8-pentamethyldipyrrolylmethen-9-yl)methane and bis(1,2,3,7,9-pentamethyldipyrrolylmethen-8-yl)trifluoromethylmethane dihydrobromides》 about this compound( cas:2199-44-2 ) in Russian Journal of General Chemistry. Keywords: bisdipyrrolylmethene preparation UVvis thermal oxidative degradation. We’ll tell you more about this compound (cas:2199-44-2).

(1,2,3,7,9-Pentamethyldipyrrolylmethen-8-yl)(1,2,3,7,8-pentamethyldipyrrolylmethen-9-yl)-methane and bis(1,2,3,7,9-pentamethyldipyrrolylmethen-8-yl)trifluoromethylmethane hydrobromides were synthesized and characterized spectrally (1H NMR, IR, electron absorption spectra). A comparative study was performed of the effect of the bonding site (α- or β-position of the dipyrrolylmethene) with the methane structural fragment connecting two dipyrrolylmethene chromophores, and trifluoromethyl group on the spectral properties of the mols. of compounds dissolved in organic solvents of different nature and their resistance to thermal oxidative degradation

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The reaction of an aromatic heterocycle with a proton is called a protonation. One of articles about this theory is 《Derivatives of pyrrylazobenzenearsonic acids》. Authors are Muic, N.; Fles, D..The article about the compound:Ethyl 3,5-Dimethyl-2-pyrrolecarboxylatecas:2199-44-2,SMILESS:O=C(C1=C(C)C=C(C)N1)OCC).SDS of cas: 2199-44-2. Through the article, more information about this compound (cas:2199-44-2) is conveyed.

cf. C.A. 45, 9526a. The synthesis is essentially the same as previously described. 2,4-Dimethyl-3,5-carbethoxypyrrole (I) was prepared by the method of Knorr. I was saponified in 10% KOEt, and converted to 2,4-dimethyl-3-carbethoxy-5-pyrrolecarboxylic acid (II) by the method of Küster, et al. (C.A. 16, 3895). Decarboxylation of II by dry distillation gave 2,4-dimethyl-3-carbethoxypyrrole (III). I was also treated with concentrated H2SO4 by the method of Fischer and Walach (C.A. 20, 1620) to give 2,4-dimethyl-5-carbethoxy-3-pyrrolecarboxylic acid, which was decarboxylated by heating at atm. pressure to 2,4-dimethyl-5-carbethoxypyrrole (IV). Attempts to couple diazotized 4, 3-H2N(O2N)C6H3AsO3H2 and III were not successful; a resinous product, which could not be purified, was obtained, and III was isolated from the reaction mixture Attempts to couple a salt of diazotized 3,4-H2N(HO)C6H3AsO3H2 (V) with IV were also unsuccessful. p-H2NC6H4AsO3H2 (4.34 g.) in 50 cc. H2O containing 1.63 cc. concentrated H2SO4 was diazotized with 20 cc. N NaNO2 at 0-5° and the product filtered into 3.34 g. III in 200 cc. absolute EtOH. 4-(3-Carbethoxy-2,4-dimethyl-5-pyrrylazo)benzenearsonic acid (VI) precipitated as an orange-yellow powder. VI was filtered, rinsed with water, dissolved in aqueous NaOH, and the solution clarified with active C; acidification with dilute HCl gave 4.3 g. VI, orange-yellow microcrystals, decompose 210°, slightly soluble in water, somewhat more soluble in EtOH, nearly insoluble in C6H6 and ether, and soluble in dioxane; crystallization from dioxane gave well-formed needles. VI was precipitated from alk. solution with dilute acids. VI was stable in air under light. V (4.66 g.) in 70 cc. H2O containing 5.8 cc. concentrated H2SO4 was diazotized as above and the product filtered into 3.34 g. III in 200 cc. absolute EtOH. 2-(3-Carbethoxy-2,4-dimethyl-5-pyrrylazo)-1-phenol-4-arsonic acid (VII) precipitated, and addnl. amounts of VII were obtained on diluting with H2O. VII was then dissolved in N NaOH, the solution clarified with active C, added to 0.1 N HCl with constant stirring, and the precipitate was filtered, washed with H2O, dried, and recrystallized twice from dioxane to yield 7.2 g. VII, yellow needles, decompose 160°. VII was stable in air under light. (p-H2NC6H4)2As(:O)OH (1.46 g.) in 30 cc. H2O containing 3.7 cc. concentrated HCl was diazotized as above with 10 cc. N NaNO2 and the solution added dropwise at 5° or lower to 1.67 g. III in 70 cc. EtOH containing 5 g. NaOAc, previously dissolved in a small volume of H2O, to yield di-Et 5, 5′-[arsinobis(p-phenyleneazo)]bis[2,4-dimethyl-3-pyrrolecarboxylate] (VIII). VIII was filtered, washed with cold H2O, dried in vacuo, and recrystallized from dioxane and then from ether to yield 1 g. VIII, dark orange microcrystals, m. 151° (decomposition). VIII was soluble in EtOH, dioxane, and CHCl3. p-H2NC6H4AsO3H2 (2.17 g.) in 25 cc. H2O containing 0.81 cc. concentrated H2SO4 was diazotized with 10 cc. N NaNO2 and the product filtered into 1.67 g. IV in 200 cc. absolute EtOH; when the solution was clear 15 g. NaOAc in a small amount of H2O was added with cooling, and, after 1 hr., 4 l. H2O was added to precipitate 4-(5-carbethoxy-2,4-dimethyl-3-pyrrylazo)benzenearsonic acid (IX), yellow-orange powder. IX was twice dissolved in alkali and reprecipitated by dilute HCl, washed with water, and dried in vacuo to yield 1.2 g. IX, darkens 100°, m. 185° (decomposition), IX was soluble in EtOH and dioxane, and stable in air under light.

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In general, if the atoms that make up the ring contain heteroatoms, such rings become heterocycles, and organic compounds containing heterocycles are called heterocyclic compounds. An article called Synthesis of pyrrolecarboxaldehydes, published in 1956, which mentions a compound: 2199-44-2, Name is Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate, Molecular C9H13NO2, Application of 2199-44-2.

HCO-NMe2 (I) (23.89 g.) and 58.25 g. POCl3 warmed after 10 min. to 60°, treated dropwise in 1.5 hrs. with 18 g. 2,4-dimethylpyrrole in an equal volume of I, the mixture stirred 1 hr. at 60°, poured into 333 g. ice and 245 g. fused NaOAc, the mixture boiled, cooled, extracted with Et2O, the extract evaporated free from Et2O and made alk. with powd. Na2CO3, filtered, and the residual product (II) dried. Further extraction of the filtrate with Et2O gave another 0.69 g. II. II boiled in petr. ether, the solution purified with C, filtered and cooled gave 0.6 g. (crude) 2,4-dimethyl-3,5-pyrroledicarboxaldehyde, m. 165-6° (from H2O), and 9.6 g. (crude) 2,4-dimethyl-5-pyrrolecarboxaldehyde, m. 89-90° (from H2O). Similarly, I and POCl3 at 60°, treated dropwise with stirring with 2,4-dimethyl-8-ethylpyrrole gave 2,4-dimethyl-3-ethyl-5-pyrrolecarboxaldehyde, m. 105-6°. In the same way, 1.79 g. I and 4.37 g. POCl3 treated with 1.35 g. 2,3,4-trimethylpyrrole gave 0.3 g. 2,3,4-trimethyl-5-pyrrolecarboxaldehyde, m. 147°; 2.6 g. I and 6.32 g. POCl3 with 3 g. Et 2,4-dimethyl-3-pyrrolecarboxylate in I yielded Et 2,4-dimethyl-5-formyl-3-pyrrolecarboxylate, m. 165°; 8.6 g. I and 21 g. POCl3 with 10 g. Et 2,4-dimethyl-5-pyrrolecarboxylate and 10 g. I produced 11.2 g. Et 2,4-dimethyl-3-formyl-5-pyrrolecarboxylate, m. 145°. Heating 20 g. 2,4-dimethyl-5-carbethoxy-3-pyrrolecarboxylate at 200° with 200 g. quinoline and 2 g. finely divided pure Cu to cessation of CO2 evolution, cooling, filtering, acidifying the filtrate with 50% HCl, filtering, washing the precipitate with H2O, and drying gave 11.2 g. Et 2,4-dimethyl-5-pyrrolecarboxylic acid, m. 122°.

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In organic chemistry, atoms other than carbon and hydrogen are generally referred to as heteroatoms. The most common heteroatoms are nitrogen, oxygen and sulfur. Now I present to you an article called Decarboxylation and formylation of certain pyrrole derivatives, published in 1954, which mentions a compound: 2199-44-2, mainly applied to , Name: Ethyl 3,5-Dimethyl-2-pyrrolecarboxylate.

H2NCH2CH2OH (I) is used as decarboxylation agent for substituted carboxypyrroles. Adding 28.5 g. AcCH2CO2Et to Et α-nitroso-α-benzoylacetate (from 38.5 g. BzCH2CO2Et), then adding gradually 28.5 g. Zn dust with gentle boiling, refluxing the mixture 2 hrs., and pouring it into H2O give 63% 2-methyl-4-phenyl-3,5-dicarbethoxypyrrole, colorless prisms, m. 124-5°. 2,4-Dimethyl-3-carboxy-5-carbethoxypyrrole (II), 85%, fine prisms, m. 272° (decomposition), and 2-methyl-4-phenyl-3-carboxy-5-carbethoxypyrrole (III), 78%, platelets, m. 220° (decomposition) are prepared by partial saponification of the corresponding diesters. Refluxing 21.1 g. II and 12.2 g. I 1 hr. and pouring the mixture into H2O give 90% 2,4-dimethyl-5-carbethoxypyrrole (IV), prisms, m. 124.5-5°; similarly, III gives 84% 2-methyl-4-phenyl-5-carbethoxypyrrole, needles, m. 134.5-5°. Gradually adding 15.4 g. POCl3 to 13.4 g. IV and 7.3 g. HCONMe2, refluxing the mixture 2 hrs., pouring it into H2O, and neutralizing it with NaOAc give 95% 2,4-dimethyl-3-formyl-5-carbethoxypyrrole, needles, m. 145-5.5° (oxime, m. 199-200°; semicarbazone, decompose at about 275°). 2-Methyl-4-phenyl-3-formyl-5-carbethoxypyrrole, prepared similarly in 97% yield, prisms, m. 144.5-5° (oxime, 96%, plates, m. 210-11°; semicarbazone, needles, decompose at about 280° with sublimation).

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