Search results for "Methylcyclohexane"

showing 10 items of 16 documents

Photophysical behavior of 3-methylquinoline and 3-bromoquinoline

1992

Abstract The phosphorescence emission and excitation spectra and their polarizations have been studied for 3-methylquinoline and 3-bromoquinoline in methylcyclohexane and ethanol glasses at 77 K. From the results obtained in 3-methylquinoline (τp = 1.30 s in ethanol, τp = 1.05 s in methylcyclohexane and the out-of-plane polarization) it is concluded that the emission originates from a triplet state of 3ππ∗ character. In 3-bromoquinoline, the phosphorescence lifetimes (ca. 8 ms in a non-polar solvent and 15 ms in a polar solvent) and the negative degree of polarization indicate an emitting state of ππ∗ character that is strongly coupled to a higher-lying triplet state of the nπ∗ type. The mo…

Absorption spectroscopyChemistryBiophysicsGeneral ChemistryCondensed Matter PhysicsPhotochemistryBiochemistryAtomic and Molecular Physics and OpticsSolventchemistry.chemical_compoundMoleculeDegree of polarizationMethylcyclohexaneTriplet statePolarization (electrochemistry)PhosphorescenceJournal of Luminescence
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Phase equilibria in the systems 3-methylpentane + methylcyclohexane, diisopropyl ether + methylcyclohexane and 3-methylpentane + diisopropyl ether + …

2002

Abstract Consistent vapor–liquid equilibria (VLE) at 101.3 kPa has been determined for the ternary system 3-methylpentane+diisopropyl ether (DIPE)+methylcyclohexane and the binary subsystems 3-methylpentane+methylcyclohexane and DIPE+methylcyclohexane in the temperature range from 336 to 374 K. According to the experimental results, the systems exhibit slight positive deviation from ideal behavior and no azeotrope is present. The VLE data have been correlated with the composition using the Wilson, UNIQUAC and NRTL relations. These models allow good prediction of the VLE properties of the ternary system from those of the pertinent binary subsystems.

Activity coefficientUNIQUACTernary numeral systemGeneral Chemical EngineeringGeneral Physics and AstronomyThermodynamicschemistry.chemical_compoundchemistryAzeotropeNon-random two-liquid modelDiisopropyl etherPhysical and Theoretical ChemistryMethylcyclohexane3-MethylpentaneFluid Phase Equilibria
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Vapor−Liquid Equilibria for the Binary Systems tert-Butyl Alcohol + Toluene, + Isooctane, and + Methylcyclohexane at 101.3 kPa

1998

Vapor-liquid equilibria were measured for binary systems of tert-butyl alcohol with toluene, isooctane, and methylcyclohexane at 101.3 kPa using a recirculating still. Experimental values of the vapor pressure of non-oxygenated pure components have been obtained. The accuracy of experimental measurements was ±0.01 K in temperature, ±0.01 kPa in pressure, and ±0.001 in mole fractions. The results are thermodynamically consistent according to the point-to-point consistency test. The data were correlated with five liquid-phase activity coefficients models (Margules, Van Laar, Wilson, NRTL, UNIQUAC).

Activity coefficientUNIQUACVapor pressureGeneral Chemical EngineeringThermodynamicsGeneral ChemistryTolueneGroup contribution methodchemistry.chemical_compoundchemistryNon-random two-liquid modelOrganic chemistryBinary systemMethylcyclohexaneJournal of Chemical & Engineering Data
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Phosphorescence emission and polarization of quinoline 3-carbonitrile

1993

Abstract The phosphorescence emission and excitation spectra and their polarization have been studied for quinoline 3-carbonitrile in methylcyclohexane and ethanol glasses at 77 K. From the results obtained in this molecule (τ=1.15 sec in ethanol, τ=1.04 sec in methylcyclohexane and out-of-plane polarization) it is concluded that the emission is orginated from a triplet state of 3 ππ * character. The two major spin-orbit coupling mechanisms through which the ππ * state of quinoline 3-carbonitrile acquires dipole-allowed character via nπ * states are: 1. In ethanol glass: 2. In methylcyclohexane glass:

NitrileOrganic ChemistryQuinolinePhotochemistryAnalytical ChemistryInorganic Chemistrychemistry.chemical_compoundchemistryMoleculeEmission spectrumMethylcyclohexaneTriplet statePolarization (electrochemistry)PhosphorescenceSpectroscopyJournal of Molecular Structure
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The oxidation of alkanes with dimethyldioxirane; a new mechanistic insight

1997

Abstract Primary kinetic isotope effects were measured for the oxidation of cyclohexane and methylcyclohexane with DMDO in solution and in the gas phase. These experiments suggest an electrophilic oxygen insertion mechanism for the oxidation of alkanes by DMDO.

Primary (chemistry)CyclohexaneOrganic Chemistrychemistry.chemical_elementPhotochemistryBiochemistryOxygenchemistry.chemical_compoundchemistryMechanism (philosophy)Drug DiscoveryKinetic isotope effectElectrophileMethylcyclohexaneDimethyldioxiraneTetrahedron Letters
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Vapor-liquid equilibria for the binary systems of methylcyclohexane with 1-propanol, 2-propanol, 1-butanol, and 2-butanol at 101.3 kPa

1997

Isobaric vapor−liquid equilibrium measurements at 101.3 kPa are reported for the binary systems methylcyclohexane + 1-propanol, + 2-propanol, + 1-butanol, and + 2-butanol. The systems show a strong positive deviation from ideality and present a minimum temperature azeotrope. The activity coefficients were found to be thermodynamically consistent by the methods of Van Ness−Byer−Gibbs and Wisniak. The date were correlated with five liquid-phase activity coefficient models (Margules, Van Laar, Wilson, NRTL, and UNIQUAC). According to the average deviations in temperature and in vapor composition the best model for the systems is NRTL.

PropanolActivity coefficientchemistry.chemical_compoundUNIQUACchemistryButanolAzeotropeGeneral Chemical EngineeringNon-random two-liquid modelThermodynamicsGeneral ChemistryMethylcyclohexane2-Butanol
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CCDC 1979791: Experimental Crystal Structure Determination

2020

Related Article: Elena A. Mikhalyova, Matthias Zeller, Jerry P. Jasinski, Raymond J. Butcher, Luca M. Carrella, Alexander E. Sedykh, Konstantin S. Gavrilenko, Sergey S. Smola, Michael Frasso, Sebastian Calderon Cazorla, Kuluni Perera, Anni Shi, Habib G. Ranjbar, Casey Smith, Alexandru Deac, Youlin Liu, Sean M. McGee, Vladimir P. Dotsenko, Michael U. Kumke, Klaus Müller-Buschbaum, Eva Rentschler, Anthony W. Addison, Vitaly V. Pavlishchuk|2020|Dalton Trans.|49|7774|doi:10.1039/D0DT00600A

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters(mu-13-bis(3-acetylacetonato)benzene)-tetrakis(hydrogen tripyrazolylborate)-di-gadolinium methylcyclohexane unknown solvateExperimental 3D Coordinates
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CCDC 1451618: Experimental Crystal Structure Determination

2016

Related Article: S. Chelli, K. Troshin, S. Lakhdar, H. Mayr, P. Mayer|2016|Acta Crystallogr.,Sect.E:Cryst.Commun.|72|300|doi:10.1107/S2056989016002085

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters2-(chloro(4-methoxyphenyl)methyl)-2-(4-methoxyphenyl)-55-dimethylcyclohexane-13-dioneExperimental 3D Coordinates
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CCDC 2021077: Experimental Crystal Structure Determination

2020

Related Article: Andrey V. Protchenko, Petra Vasko, M. Ángeles Fuentes, Jamie Hicks, Dragoslav Vidovic, Simon Aldridge|2021|Angew.Chem.,Int.Ed.|60|2064|doi:10.1002/anie.202011839

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameterspotassium 1-[26-diisopropylphenyl]-99-dimethyl-5-isopropyl-1H9H-[132]diazaborolo[12-a][12]benzazaborolide methylcyclohexaneExperimental 3D Coordinates
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Influence of theZ/EIsomerism on the Pathway Complexity of a Squaramide‐Based Macrocycle

2020

The rising interest on pathway complexity in supramolecular polymerization has prompted the finding of novel monomer designs able to stabilize kinetically trapped species and generate supramolecular polymorphs. In the present work, the exploitation of the Z/E (geometrical) isomerism of squaramide (SQ) units to produce various self-assembled isoforms and complex supramolecular polymerization pathways in methylcyclohexane/CHCl3 mixtures is reported for the first time. This is achieved by using a new bissquaramidic macrocycle (MSq) that self-assembles into two markedly different thermodynamic aggregates, AggA (discrete cyclic structures) and AggB (fibrillar structures), depending on the solven…

Supramolecular chemistry02 engineering and technology010402 general chemistry01 natural sciencesPolymerizationBiomaterialschemistry.chemical_compoundIsomerismSpectroscopy Fourier Transform InfraredGeneral Materials ScienceConformational isomerismchemistry.chemical_classificationQuinineHydrogen bondSquaramideHydrogen BondingGeneral Chemistry021001 nanoscience & nanotechnology0104 chemical sciencesSupramolecular polymersCrystallographyMonomerPolymerizationchemistryMethylcyclohexane0210 nano-technologyBiotechnologySmall
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