Month: April 2022

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: 56413-95-7, is researched, Molecular C6Cl2N4, about Dicyanopyrazine studies. part IV: syntheses and solid state absorption spectra of new dicyanopyrazine dyes derived from dichlorodicyanopyrazine and Fischer’s type bases, the main research direction is dye dicyanopyrazine preparation spectra MO.Category: chiral-oxygen-ligands.

2-Chloro-5,6-dicyano-3-[2-(1,3,3-trimethylindolinylidene)methyl]pyrazine showed large differences in λmax from solution to the solid state resulting from strong intermol. π-π interactions. Related derivatives were synthesized by the nucleophilic substitution of 2,3-dichloro-5,6-dicyanopyrazine with various Fischer’s base type enamines. Absorption spectra, fluorescent properties and other phys. properties were correlated with their chem. structures. The PPP MO and MOPAC approach to evaluate their absorption spectra correlate with their conformations were conducted. Good correlation between the calculated and the exptl. results were obtained. The substituent effects of dicyanopyrazines affecting their chem., electronic, and phys. properties were also studied.

There is still a lot of research devoted to this compound(SMILES：N#CC1=NC(Cl)=C(Cl)N=C1C#N)Category: chiral-oxygen-ligands, and with the development of science, more effects of this compound(56413-95-7) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

COA of Formula: C6Cl2N4. 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. Compound: 5,6-Dichloropyrazine-2,3-dicarbonitrile, is researched, Molecular C6Cl2N4, CAS is 56413-95-7, about Synthesis and solution studies on azaphthalocyanines with quaternary aminoethyl substituents.

A pyrazinedinitrile derivative carrying dimethylaminoethylsulfanyl groups at positions 5 and 6 was synthesized from 2-dimethylaminoethanethiol hydrochloride and 2,3-dicarbonitrile-5,6-dichloropyrazine. The dicarbonitrile gave magnesium azaphthalocyanine (MgAzaPc) when reacted with magnesium propoxide in propanol. The conversion of the MgAzaPc to a metal-free derivative was achieved by treatment with trifluoroacetic acid. Incorporation of transition metal ions into the inner core of azaphthalocyanine was accomplished by treatment of the metal-free derivative with metal acetates, i.e. Zn(OAc)2, Co(OAc)2. These azaphthalocyanines were converted into water-soluble quaternised products by reaction with Me iodide. Aggregation phenomena were followed for magnesium azaphthalocyanine with quaternisable dimethylamino substituents within a specific range of pH. The compounds were characterized by FTIR, 1H NMR, mass and UV-visible spectral data.

There is still a lot of research devoted to this compound(SMILES：N#CC1=NC(Cl)=C(Cl)N=C1C#N)COA of Formula: C6Cl2N4, and with the development of science, more effects of this compound(56413-95-7) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

The reaction of an aromatic heterocycle with a proton is called a protonation. One of articles about this theory is 《Synthesis of α,α’-unsubstituted pyrroles》. Authors are Plieninger, H.; Buhler, W..The article about the compound:3-Methyl-1H-pyrrolecas:616-43-3,SMILESS:CC1=CNC=C1).Product Details of 616-43-3. Through the article, more information about this compound (cas:616-43-3) is conveyed.

α,α’-Unsubstituted pyrroles were made as intermediates for the synthesis of porphyrins and bile pigments. 3-Methylpyrrole (I) and 3,4-dimethylpyrrole were obtained in 40% yield (based on the starting acetal) from MeCOCH2CH(OMe)2 (II) and MeCOCHMeCH(OMe)2, resp. II cyanohydrin was condensed with dihydropyrene (III) to give MeC(CN)(OCH.CH2.CH2.CH2.CH2.O)CH2CH(OMe)2 which was reduced to the corresponding amine with LiAlH4. Acidification liberated the pyrrole but because of further transformation in the presence of acid, it could not be isolated. Acetylation of the amine, followed by treatment with MeC6H4SO3H in absolute Me2CO, split off III, liberated the aldehyde group and gave I acetyl derivative in one step. I was obtained by careful alk. hydrolysis.

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Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

COA of Formula: C6Cl2N4. The mechanism of aromatic electrophilic substitution of aromatic heterocycles is consistent with that of benzene. Compound: 5,6-Dichloropyrazine-2,3-dicarbonitrile, is researched, Molecular C6Cl2N4, CAS is 56413-95-7, about Cationic azaphthalocyanines bearing aliphatic tertiary amino substituents-Synthesis, singlet oxygen production and spectroscopic studies. Author is Zimcik, Petr; Miletin, Miroslav; Musil, Zbynek; Kopecky, Kamil; Kubza, Lukas; Brault, Daniel.

New cationic zinc azaphthalocyanines (AzaPc) were prepared using a statistical method of synthesis starting from 5,6-bis(2-diethylaminoethylsulfanyl)pyrazine-2,3-dicarbonitrile (A) and 5,6-bis(tert-butylsulfanyl)pyrazine-2,3-dicarbonitrile (B). All the six possible AzaPc derivatives were detected on TLC but only five of them were finally isolated using column chromatog. on silica (excluding AAAB type). The adjacent (AABB) and opposite (ABAB) isomers were well separated Singlet oxygen quantum yields (ΦΔ) were measured using the DPBF decomposition method. Values of ΦΔ in anhydrous DMF drastically decrease with the number of amino groups from 0.66 for BBBB type to 0.04 for AAAA type. The same dependence was observed in anhydrous DMF for the corresponding hydrochlorides. When DMF/water 95:5 added with HCl was used, the ΦΔ values for amino AzaPc increased to approx. 0.66. This suggests that solvation of the amino and Cl- ions plays an important role in the separation of the AzaPc mols. although no changes were found in UV-vis spectra. At least eight cationic charges are necessary for complete monomerization of AzaPc in water. Fewer charges lead to significant decrease of the absorption in the area of the Q-band and to pronounced dimeric character of the absorption spectrum.

There is still a lot of research devoted to this compound(SMILES：N#CC1=NC(Cl)=C(Cl)N=C1C#N)COA of Formula: C6Cl2N4, and with the development of science, more effects of this compound(56413-95-7) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Reference of cis-4-Aminocyclohexane carboxylic acid. Aromatic heterocyclic compounds can also be classified according to the number of heteroatoms contained in the heterocycle: single heteroatom, two heteroatoms, three heteroatoms and four heteroatoms. Compound: cis-4-Aminocyclohexane carboxylic acid, is researched, Molecular C7H13NO2, CAS is 3685-23-2, about Synthesis of peptides containing cis- or trans-3- or 4-aminocyclohexanecarboxylic acid residues. Author is Skaric, Vinko; Kovacevic, Mice; Skaric, Djurdja.

Et tert-butoxycarbonylphenylalanyl-trans- and -cis-4-aminocyclohexanecarboxylates were prepared by coupling the N-hydroxysuccinimido ester of tert-butoxycarbonylphenylalanine with a mixture of isomers of Et 4-aminocyclohexanecarboxylate. Treatment of the hydroxysuccinimido esters of tert-butoxycarbonylphenylalanyl-trans-4- and -cis-3-aminocyclohexanecarboxylic acids with S-benzylcysteine Me ester gave tert-butoxycarbonylphenylalanyl-trans-4- and -cis-3-aminocyclohexylcarbonyl-S-benzylcysteine Me ester.

There is still a lot of research devoted to this compound(SMILES：N[C@H]1CC[C@H](CC1)C(O)=O)Reference of cis-4-Aminocyclohexane carboxylic acid, and with the development of science, more effects of this compound(3685-23-2) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Quality Control of cis-4-Aminocyclohexane carboxylic acid. The reaction of aromatic heterocyclic molecules with protons is called protonation. Aromatic heterocycles are more basic than benzene due to the participation of heteroatoms. Compound: cis-4-Aminocyclohexane carboxylic acid, is researched, Molecular C7H13NO2, CAS is 3685-23-2, about Proton NMR spectroscopic study of the stereoconfiguration and conformation of cis and trans isomers of 3- and 4-aminocyclohexylalkanoic acids. Author is Palaima, A.; Staniulyte, Z.; Juodvirsis, A..

1H NMR spectral data for cyclohexane H1, H3 or H1, H4 protons of cis- and trans-3- and 4-aminocyclohexanealkanoic acids were successfully used for determination of the stereoconfigurations and conformational equilibrium of sep. isomers and for determination of cis/trans ratio in their mixtures by using Pr(NO3)3 and Eu(fod)3 as shift-reagents. For that purpose NMR data of the alkanoic substituents of the cyclohexane ring can also be used.

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Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Fier, Patrick S.; Kim, Suhong; Cohen, Ryan D. published an article about the compound: 5,6-Dichloropyrazine-2,3-dicarbonitrile( cas:56413-95-7,SMILESS:N#CC1=NC(Cl)=C(Cl)N=C1C#N ).Category: chiral-oxygen-ligands. Aromatic heterocyclic compounds can be classified according to the number of heteroatoms or the size of the ring. The authors also want to convey more information about this compound (cas:56413-95-7) through the article.

The development of a multifunctional reagent for the direct conversion of pyridines to Boc-protected 2-aminopyridines such as I [R = H, 3-Br, 4-Ph, etc.] with exquisite site selectivity and chemoselectivity was reported. The novel reagent was prepared on 200g scale in a single step, reacted in title reaction under mild conditions without precautions toward air or moisture, and is tolerant of nearly all common functionality. Exptl. and in situ spectroscopic monitoring techniques provided detailed insights and unexpected findings for the unique reaction mechanism.

There is still a lot of research devoted to this compound(SMILES：N#CC1=NC(Cl)=C(Cl)N=C1C#N)Category: chiral-oxygen-ligands, and with the development of science, more effects of this compound(56413-95-7) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Shimoda, Mitsuya; Shiratsuchi, Hideki; Nakada, Yuji; Wu, Yin; Osajima, Yutaka published the article 《Identification and Sensory Characterization of Volatile Flavor Compounds in Sesame Seed Oil》. Keywords: volatile flavor compound sesame seed oil.They researched the compound: 3-Methyl-1H-pyrrole( cas:616-43-3 ).Recommanded Product: 616-43-3. Aromatic heterocyclic compounds can be divided into two categories: single heterocyclic and fused heterocyclic. In addition, there is a lot of other information about this compound (cas:616-43-3) here.

Volatile flavor compounds in sesame seed oil were investigated. Com. processed sesame seed oil was steam distilled under reduced pressure, and volatiles from the distillate were separated by an adsorptive column method. Among 171 individual peaks detected, 134 peaks were definitely or tentatively identified by anal. of mass spectra and modified Kovats indexes. To elucidate the compounds directly contributing to the characteristic flavor, the odor concentrate was fractionated by silica gel thin-layer chromatog. and preparative gas chromatog. As a result, 1-(5-methyl-2-furanyl)-1-propanone, 3-formylthiophene, 2-propyl-4-methylthiazole, 2-ethyl-4-methyl-1H-pyrrole, 2-ethyl-6-methylpyrazine, 2-ethyl-5-methylpyrazine, 4,5-dimethylisothiazole, 4,5-dimethylthiazole, 2,6-diethylpyrazine, 2-ethyl-2,5-dimethylpyrazine, 1-(2-pyridinyl)ethanone, and 1-(1-methyl-1H-pyrrol-2-yl)ethanone were considered to be principal contributors of sesame seed oil flavor.

There is still a lot of research devoted to this compound(SMILES：CC1=CNC=C1)Recommanded Product: 616-43-3, and with the development of science, more effects of this compound(616-43-3) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Computed Properties of C6Cl2N4. Aromatic heterocyclic compounds can also be classified according to the number of heteroatoms contained in the heterocycle: single heteroatom, two heteroatoms, three heteroatoms and four heteroatoms. Compound: 5,6-Dichloropyrazine-2,3-dicarbonitrile, is researched, Molecular C6Cl2N4, CAS is 56413-95-7, about A Multifunctional Reagent Designed for the Site-Selective Amination of Pyridines. Author is Fier, Patrick S.; Kim, Suhong; Cohen, Ryan D..

The development of a multifunctional reagent for the direct conversion of pyridines to Boc-protected 2-aminopyridines such as I [R = H, 3-Br, 4-Ph, etc.] with exquisite site selectivity and chemoselectivity was reported. The novel reagent was prepared on 200g scale in a single step, reacted in title reaction under mild conditions without precautions toward air or moisture, and is tolerant of nearly all common functionality. Exptl. and in situ spectroscopic monitoring techniques provided detailed insights and unexpected findings for the unique reaction mechanism.

There is still a lot of research devoted to this compound(SMILES：N#CC1=NC(Cl)=C(Cl)N=C1C#N)Computed Properties of C6Cl2N4, and with the development of science, more effects of this compound(56413-95-7) can be discovered.

Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate

Related Products of 56413-95-7. The protonation of heteroatoms in aromatic heterocycles can be divided into two categories: lone pairs of electrons are in the aromatic ring conjugated system; and lone pairs of electrons do not participate. Compound: 5,6-Dichloropyrazine-2,3-dicarbonitrile, is researched, Molecular C6Cl2N4, CAS is 56413-95-7, about Syntheses of 1,4,5,8-tetraazanaphthalene derivatives from diaminomaleonitrile. Author is Mitsuhashi, Keiryo; Yanagida, Takeshi; Murakami, Akira; Oda, Kunihiko; Shiraishi, Shinsaku.

Cyclization of diaminomaleonitrile (I) with (COCl)2 in dioxane gave 70% II. Chlorination of II by POCl3 gave 50% III. Amination off III by NH3 in DMF gave 90% IV. Cyclization of IV with (COCl)2 and chlorination by POCl3 gave 50% V. Cyclization of I with III gave 90% 2,3,6,7-tetracyano-1,4-dihydro-1,4,5,8-tetraazanaphthalene (VI). Oxidation of VI by 2,3-dichloro-5,6-dicyano-1,4-benzoquinone gave VII.

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Reference:
Synthesis and Crystal Structure of a Chiral C3-Symmetric Oxygen Tripodal Ligand and Its Applications to Asymmetric Catalysis,
Chiral lanthanide(III) complexes of sulphur–nitrogen–oxygen ligand derived from aminothiourea and sodium D-camphor-β-sulfonate