Search results for "Aniline"

showing 10 items of 259 documents

CCDC 1021542: Experimental Crystal Structure Determination

2014

Related Article: Sandip Bhowmik, Biswa Nath Ghosh, Kari Rissanen|2014|Org.Biomol.Chem.|12|8836|doi:10.1039/C4OB01867B

Space GroupCrystallographydichloro-(4-(22':6'2''-terpyridin-4'-yl)aniline)-cadmium(ii)Crystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Azo-Sulforhodamine Dyes: A Novel Class of Broad Spectrum Dark Quenchers

2014

A rapid access to a novel class of water-soluble dark quencher dyes was achieved using an azo-coupling reaction between a fluorescent primary arylamine derived from a sulforhodamine 101 scaffold and a tertiary aniline equipped with different bioconjugatable groups. The thus obtained nonfluorescent azo-sulforhodamine hybrids display a broad quenching range spanning the visible to NIR regions. This was demonstrated through the preparation and enzymatic activation of FRET-based fluorogenic substrates of urokinase.

Spectrophotometry InfraredPhotochemistryBiochemistryBroad spectrumchemistry.chemical_compoundAnilineRapid accessDark quencher[CHIM]Chemical SciencesPhysical and Theoretical ChemistryColoring AgentsComputingMilieux_MISCELLANEOUSFluorescent DyesAniline CompoundsQuenching (fluorescence)Molecular StructureRhodaminesOrganic ChemistryWaterSulforhodamine 101Fluorescence3. Good healthFörster resonance energy transferSolubilitychemistryAzo Compounds
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In vivo and in vitro anti-leishmanial activities of 4-nitro-N-pyrimidin- and N-pyrazin-2-ylbenzenesulfonamides, and N2-(4-nitrophenyl)-N1-propylglyci…

2009

A series of compounds containing the nitrobenzene and sulfonamido moieties were synthesized and their leishmanicidal effect was assessed in vitro against Leishmania infantum promastigotes. Among the compounds evaluated, the p-nitrobenzenesulfonamides 4Aa and 4Ba, and the p-nitroaniline 5 showed significant activity with a good selectivity index. In a Balb/c mice model of L. Infantum, administration of compounds 4Aa, 4Ba or 5 (5 mg/kg/day for 10 days, injected ip route) led to a clear-cut parasite burden reduction (ca. 99%). In an attempt to elucidate their mechanism of action, the DNA interaction of 4Aa and 5 was investigated by means of viscosity studies, thermal denaturation and nuclease …

StereochemistryClinical BiochemistryNitro compoundGlycinePharmaceutical ScienceBiochemistryChemical synthesisMiceIn vivoDrug DiscoverymedicineAnimalsMolecular BiologyLeishmaniasischemistry.chemical_classificationNucleaseMice Inbred BALB CSulfonamidesAniline CompoundsbiologyOrganic Chemistrybiology.organism_classificationTrypanocidal AgentsIn vitroPyrimidineschemistryMechanism of actionBiochemistrybiology.proteinNitroMolecular MedicineLeishmania infantummedicine.symptomBioorganicmedicinal chemistry
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Herbizide, VI [1] kernfluorierte 2,4-dianilino-6-(dihexylamino)-1,3,5-triazine

1985

Zusammenfassung Auf dem Wege der nucleophilen Substitution der Chloratome in 2,4-Dichlor- 6-(dihexylamino)-1,3,5-triazin durch Anilin werden das 2,4-Dianilino-6-(dihexylamino)-1,3,5-triazin und durch fluorierte Amine die (Dihexylamino)- 1,3,5-triazine mit den folgenden Resten zuganglich: (2-Fluoranilino)-, (3-Fluoranilino)-, (4-Fluoranilino)-, (2,4-Difluoranilino)-, (2,5-Difluoranilino)- und (2,6-Difluoranilino)-. Zur Charakterisierung der neuen Verbindungen sind die IR-, 1 H-NMR- und Massenspektroskopie herangezogen worden. 2,4-Bis-(2,4-difluoranilino)-6-(dihexylamino)-1,3,5-triazin vermag insbesondere herbizide und antidiabetische Wirkungen auszuuben.

StereochemistryOrganic ChemistryNuclear magnetic resonance spectroscopyBiochemistryMedicinal chemistryInorganic Chemistrychemistry.chemical_compoundAnilinechemistry135-TriazineNucleophilic substitutionMass spectrumEnvironmental ChemistryPhysical and Theoretical ChemistryJournal of Fluorine Chemistry
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Rearrangement products of 3-methanesulfonyl-N-methyl-N-nitroaniline.

2003

Two isomeric products (C 8 H 10 N 2 O 4 S) of the rearrangement of 3-methanesulfonyl-N-methyl-N-nitroaniline have been investigated, viz. 3-methanesulfonyl-N-methyl-2-nitroaniline, which was the main product of the rearrangement, and 5-methanesulfonyl-N-methyl-2-nitroaniline. In both molecules, the aromatic rings are appreciably deformed towards ortho-quinonoidal geometry by electronic and steric interactions. The crystal structure is stabilized, in both cases, by weak C-H...O hydrogen bonds.

Steric effectsChemistryStereochemistryHydrogen bondMoleculeAromaticityGeneral MedicineCrystal structureSigmatropic reactionMedicinal chemistryGeneral Biochemistry Genetics and Molecular BiologyNitroanilineCope rearrangementActa crystallographica. Section C, Crystal structure communications
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Substituent effects in trans-p,p'-disubstituted azobenzenes: X-ray structures at 100 K and DFT-calculated structures.

2014

The crystal and molecular structures of twopara-substituted azobenzenes with π-electron-donating –NEt2and π-electron-withdrawing –COOEt groups are reported, along with the effects of the substituents on the aromaticity of the benzene ring. The deformation of the aromatic ring around the –NEt2group inN,N,N′,N′-tetraethyl-4,4′-(diazenediyl)dianiline, C20H28N4, (I), may be caused by steric hindrance and the π-electron-donating effects of the amine group. In this structure, one of the amine N atoms demonstrates clearsp2-hybridization and the other is slightly shifted from the plane of the surrounding atoms. The molecule of the second azobenzene, diethyl 4,4′-(diazenediyl)dibenzoate, C18H18N2O4,…

Steric effectscrystal structureChemistryStereochemistry4electron-donating effectsSubstituentAromaticityCrystal structureDFT calculationsCondensed Matter PhysicsInorganic ChemistryCrystalelectron-withdrawing effectsHOMA indexCrystallographychemistry.chemical_compoundMaterials Chemistry4'-(diazenediyl)dibenzoateAmine gas treatingDensity functional theoryPhysical and Theoretical Chemistryazo­benzenesBenzene4'-(diazene­diyl)dianilineActa crystallographica. Section C, Structural chemistry
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Binding abilities of a chiral calix[4]resorcinarene: a polarimetric investigation on a complex case of study

2017

Polarimetry was used to investigate the binding abilities of a chiral calix[4]resorcinarene derivative, bearing L-proline subunits, towards a set of suitably selected organic guests. The simultaneous formation of 1:1 and 2:1 host–guest inclusion complexes was observed in several cases, depending on both the charge status of the host and the structure of the guest. Thus, the use of the polarimetric method was thoroughly revisited, in order to keep into account the occurrence of multiple equilibria. Our data indicate that the stability of the host–guest complexes is affected by an interplay between Coulomb interactions, π–π interactions, desolvation effects and entropy-unfavorable conformatio…

Supramolecular chemistryPolarimetryhost–guest complexes010402 general chemistry01 natural scienceshost-guest complexesFull Research Papersupramolecular chemistrylcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryComputational chemistryp-nitroanilinesDesolvationlcsh:Sciencepolarimetrycalix[4]resorcinarene010405 organic chemistryChemistryOrganic ChemistryHost-guest complexeSettore CHIM/06 - Chimica OrganicaResorcinarene0104 chemical sciencesChemistrylcsh:QP-nitroanilineDerivative (chemistry)Beilstein Journal of Organic Chemistry
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4-Chloro-N-methyl-N-nitroaniline

1998

The molecular structure of (p-ClC 6 H 4 )(CH 3 )NNO 2 (or C 7 H 7 ClN 2 O 2 ) contains a planar NNO 2 nitroamino group which is twisted about the N-C phenyl bond by ca 68° from the plane of the aromatic ring. The structural data are in agreement with the spectral results and indicate that there is no conjugation between the aromatic sextet and the nitroamino group. There are no specific intermolecular interactions.

Tertiary amineChemistryGroup (periodic table)StereochemistryIntermolecular forceMoleculeGeneral MedicineCrystal structureRing (chemistry)Medicinal chemistryGeneral Biochemistry Genetics and Molecular BiologyNitroanilineActa Crystallographica Section C-Crystal Structure Communications
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CCDC 881313: Experimental Crystal Structure Determination

2013

Related Article: A.N.Chernyshev, N.A.Bokach, P.V.Gushchin, M.Haukka, V.Yu.Kukushkin|2012|Dalton Trans.|41|12857|doi:10.1039/c2dt30986f

Tetrachloro-bis(3-nitroaniline)-platinum(iv) dihydrateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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Nafion® and polyaniline composite modification with Li and Mg ions

2019

Funding from European Union`s Horizon 2020 Research and Innovation Program project under grant agreement No 768789 is greatly acknowledged.

Thermogravimetric analysisMaterials science020209 energy02 engineering and technologyElectrolyteConductivity010402 general chemistry01 natural sciences7. Clean energy0104 chemical sciencesDielectric spectroscopychemistry.chemical_compoundMembranechemistryChemical engineeringNafionPolyaniline:NATURAL SCIENCES:Physics [Research Subject Categories]0202 electrical engineering electronic engineering information engineeringFourier transform infrared spectroscopyIOP Conference Series: Materials Science and Engineering
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