Search results for "Pentane"

showing 10 items of 174 documents

Conformational Properties of Nickel(II) Octaethylporphyrin in Solution. 2. A Low-Temperature Optical Absorption Spectroscopy Study

1996

We have measured the absorption spectrum of Ni(II) octaethylporphyrin in CH2Cl2 and in a 50% v/v isopentane/ethyl ether mixture as a function of temperature between 150 and 300 K and 40 and 300 K, respectively. The Soret band can be decomposed into two subbands whose frequencies differ by 220 cm-1. By analogy with resonance Raman results (Jentzen et al. J. Phys. Chem. 1996, 100, 14184−14191 (preceding paper)), we attribute the low-frequency subband to a conformer with a nonplanar macrocycle structure, whereas the high-frequency subband is interpreted as resulting from a planar conformer. The subbands' intensity ratios exhibit a solvent-dependent van't Hoff behavior between 300 and 160 K. Cr…

Absorption spectroscopyGeneral EngineeringAnalytical chemistryResonancechemistry.chemical_elementEtherlaw.inventionsymbols.namesakeIsopentanechemistry.chemical_compoundNickelchemistrylawsymbolsPhysical and Theoretical ChemistryCrystallizationRaman spectroscopyConformational isomerismThe Journal of Physical Chemistry
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Detection of an O-methyltransferase synthesising acetosyringone in methyl jasmonate-treated tobacco cell-suspensions cultures.

2013

Acetosyringone (3',5'-dimethoxy-4'-hydroxyacetophenone) is a well-known and very effective inducer of the virulence genes of Agrobacterium tumefaciens but the precise pathway of its biosynthesis in plants is still unknown. We have used two tobacco cell lines, cultured in suspension and exhibiting different patterns of accumulation of acetosyringone in their culture medium upon treatment with methyl jasmonate, to study different steps of acetosyringone biosynthesis. In the two cell lines studied, treatment with 100 mu M methyl jasmonate triggered a rapid and transient increase in acetovanillone synthase activity followed by a progressive increase in S-adenosyl-L-methionine: 5-hydroxyacetovan…

AcetosyringoneAcetosyringone5-Hydroxyacetovanillone[SDV]Life Sciences [q-bio]Nicotiana tabacumPlant ScienceCyclopentanesHorticultureAcetatesBiochemistryHydroxylationchemistry.chemical_compoundStructure-Activity RelationshipBiosynthesisSuspensionsTobacco[SDV.BV]Life Sciences [q-bio]/Vegetal BiologyOxylipinsMolecular BiologyCells CulturedJasmonic acidMethyl jasmonatebiologyDose-Response Relationship DrugMolecular StructureJasmonic acidAcetophenonesGeneral MedicineAgrobacterium tumefaciensMethyltransferasesbiology.organism_classificationO-methyltransferasechemistryBiochemistry[SDE]Environmental Sciencesbiology.proteinPhytochemistry
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Synthesis of 3-Oxa-guaianolides from Santonin

2000

Abstract This article reports on the transformation of santonin into two C10-epimeric 3-oxa-guaianolides which are 8-deoxyderivatives of several natural 3-oxaguaianolides isolated from Achillea species. The synthesis involved the photochemical rearrangement of the eudesmane skeleton into a guaiane skeleton and the transformation of the cyclopentane ring into a furan moiety with the concomitant loss of C3. Comparison of the NMR data of the synthetic products with those of the natural products confirms the β orientation of the hydroxyl group at C10 in the products isolated from Achillea.

AchilleabiologyStereochemistryOrganic Chemistrybiology.organism_classificationRing (chemistry)BiochemistryNmr datachemistry.chemical_compoundchemistryFuranDrug DiscoveryOrganic chemistryMoietyCyclopentaneSantoninTetrahedron
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Phase equilibrium for the systems diisopropyl ether, isopropyl alcohol+2,2,4-trimethylpentane and +n-heptane at 101.3kPa

2010

Abstract Consistent vapour–liquid equilibrium data for the ternary systems diisopropyl ether + isopropyl alcohol + 2,2,4-trimethylpentane and diisopropyl ether + isopropyl alcohol + n-heptane are reported at 101.3 kPa. The vapour–liquid equilibrium data have been correlated by Wilson, NRTL and UNIQUAC equations. The ternary systems do not present ternary azeotropes.

Activity coefficientTernary numeral systemUNIQUACGeneral Chemical EngineeringGeneral Physics and AstronomyThermodynamicsIsopropyl alcoholchemistry.chemical_compoundchemistryNon-random two-liquid modelDiisopropyl etherOrganic chemistry224-TrimethylpentanePhysical and Theoretical ChemistryTernary operationFluid Phase Equilibria
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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 in the systems 3-methylpentane+methyl 1,1-dimethylethyl ether and 3-methylpentane+methyl 1,1-dimethylpropyl ether at 101.3 kPa

1999

Abstract Pure-component vapor pressure of 3-methylpentane and vapor–liquid equilibrium (VLE) for the binary systems of 3-methylpentane with methyl 1,1-dimethylethyl ether (MTBE) and with methyl 1,1-dimethylpropyl ether (TAME) at 101.3 kPa have been measured. Both systems exhibit small positive deviations from ideality. They can be described as regular solutions and do not present azeotrope. The activity coefficients and boiling points of the solutions were correlated with its composition by Wilson, UNIQUAC, NRTL, and Wisniak–Tamir equations.

Activity coefficientUNIQUACVapor pressureGeneral Chemical EngineeringGeneral Physics and AstronomyEtherchemistry.chemical_compoundBoiling pointchemistryAzeotropeNon-random two-liquid modelPhysical chemistryOrganic chemistryPhysical and Theoretical Chemistry3-MethylpentaneFluid Phase Equilibria
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N-Heterocyclic Carbene Catalyzed [3+2] Cycloaddition of Enals with Masked Cinnamates for the Asymmetric One-Pot Synthesis of Adipic Acid Derivatives.

2017

A novel short entry to 3,4-disubstituted adipic acids has been developed by employing an asymmetric NHC-catalyzed [3+2] cycloaddition of enals with masked cinnammates in moderate to good yields and high stereoselectivities. The synthetic utility of the protocol was demonstrated by the basic conversion of the masked cyclopentanone intermediates to 3S,4S-disubstituted adipic acid precursors of pharmaceutically important gababutins.

AdipatesOne-pot synthesishapotCyclopentanes010402 general chemistryCyclopentanone01 natural sciencesCatalysisCatalysischemistry.chemical_compoundOrganic chemistryCinnamatesorganocatalysista116cycloadditionadipic acidAdipic acidCycloaddition ReactionMolecular Structure010405 organic chemistryOrganic ChemistrygababutinsStereoisomerismGeneral ChemistryCycloaddition0104 chemical scienceschemistryCinnamatesOrganocatalysisorgaaninen kemiaCarbeneN-heterocyclic carbeneMethaneChemistry (Weinheim an der Bergstrasse, Germany)
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Biphasic effects of cannabinoids in anxiety responses: CB1 and GABA(B) receptors in the balance of GABAergic and glutamatergic neurotransmission

2012

Biphasic effects of cannabinoids have been shown in processes such as feeding behavior, motor activity, motivational processes and anxiety responses. Using two different tests for the characterization of anxiety-related behavior (elevated plus-maze and holeboard), we first identified in wild-type C57BL/6N mice, two doses of the synthetic CB1 cannabinoid receptor agonist CP-55,940 with anxiolytic (1 mug/kg) and anxiogenic properties (50 mug/kg), respectively. To clarify the role of CB1 receptors in this biphasic effect, both doses were applied to two different conditional CB1 receptor knockout (KO) mouse lines, GABA-CB1-KO (CB1 receptor inactivation in forebrain GABAergic neurons) and Glu-CB…

AgonistMaleCannabinoid receptormedicine.drug_classmedicine.medical_treatmentGlutamic AcidCyclopentanesPharmacologyGABAB receptorBiologyAnxietyMotor ActivityAnxiolyticSynaptic TransmissionGlutamatergicMiceReceptor Cannabinoid CB1medicineAnimalsGABA Agonistsgamma-Aminobutyric AcidPharmacologyMice KnockoutBehavior AnimalDose-Response Relationship DrugCannabinoidsfood and beveragesCyclohexanolsMice Inbred C57BLPsychiatry and Mental healthPyrimidinesAnxiogenicnervous systemReceptors GABA-BGABAergiclipids (amino acids peptides and proteins)Original ArticleCannabinoidpsychological phenomena and processes
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Group contributions to the infinite dilution partial molar volumes of alkanes, alcohols, and glycols in polar organic solvents

1997

Densities of binary mixtures of polar organic solvents with alcohols were measured at 25‡C. The solvents studied were N,N-dimethylformamide, dimethylsulfoxide, and formamide while alcohols were butanol, pentanol, hexanol, and 1,4-butanediol. Density measurements of hydrocarbons (from pentane to dodecane and some heptane isomers) + N,N-dimethylformamide were also performed. From these data the apparent molar volumes of alcohols and hydrocarbons as functions of concentration were calculated. The standard partial molar volumes were obtained by extrapolation to infinite dilution and are discussed in terms of group contributions.

Alkanechemistry.chemical_classificationHeptaneDodecaneBiophysicsAnalytical chemistryAlcoholBiochemistryPentanechemistry.chemical_compoundMolar volumeHydrocarbonchemistryOrganic chemistryPhysical and Theoretical ChemistryMolecular BiologyHexanolJournal of Solution Chemistry
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Scope and Limitations of Baird's Theory on Triplet State Aromaticity: Application to the Tuning of Singlet–Triplet Energy Gaps in Fulvenes

2007

Utilizing Baird's theory on triplet state aromaticity, we show that the singlet-triplet energy gaps (DeltaE(ST)) of pentafulvenes are easily varied through substitution by as much as 36 kcal mol(-1). This exploits the fact that fulvenes act as aromatic chameleons in which the dipoles reverse on going from the singlet ground state (S(0)) to the lowest pipi* triplet state (T1); thus, their electron distributions are adapted so as to achieve some aromaticity in both states. The results are based on quantum chemical calculations with the OLYP density functional theory method and the CASPT2 ab initio method, as well as spectroscopic determination of DeltaE(ST) by triplet sensitization. The findi…

Aniline CompoundsMolecular StructureOrganic ChemistryTemperatureAb initioAromaticityCyclopentanesGeneral ChemistryElectronAlkenesCarbon DioxideHydrogen-Ion ConcentrationHydrocarbons AromaticCatalysischemistry.chemical_compoundchemistryAb initio quantum chemistry methodsChemical physicsComputational chemistryMicroscopy Electron ScanningDensity functional theorySinglet statePhysics::Chemical PhysicsTriplet stateFulveneChemistry - A European Journal
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