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Journal articles on the topic 'Fluoroaniline'

Author: Grafiati

Published: 5 June 2025

Last updated: 1 August 2025

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1

Shirani Il Beigi, Hossein. "Density functional theory study on the structural, reactivity, and electronic properties of all mono-, di-, tri-, tetra-, and penta-fluoroanilines as monomers for conducting polymers." Canadian Journal of Chemistry 90, no. 10 (2012): 902–14. http://dx.doi.org/10.1139/v2012-080.

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Electrical and structural properties of mono-, di-, tri-, tetra-, and penta-fluoroanilines as candidate monomers for new conducting polymers have been investigated using hybrid density functional theory (B3LYP/6–311+G**) based methods. The effects of the number and position of the fluorine atoms on the electrical and structural properties of fluoroanilines and their radical cations have also been investigated. The values of the vibrational frequencies, charge and spin-density distributions, ionization potentials, dipole moments, electric polarizabilities, HOMO-LUMO gaps, and the NICS values of

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2

Cao, Wenling, Erxi Song, Dongsheng Shen, and Meizhen Wang. "Cometabolism of Fluoroanilines in the Presence of 4-Fluoroaniline byRalstoniasp. FD-1." Journal of Chemistry 2015 (2015): 1–9. http://dx.doi.org/10.1155/2015/206150.

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A strain ofRalstoniasp. FD-1 capable of using 4-fluoroaniline (4-FA) as the sole carbon and nitrogen source was investigated for its ability to utilize 4-FA isomers (2-FA, 3-FA) and homologs (2,4-DFA, 3,4-DFA, and 2,3,4-TFA). Both 4-FA and 3-FA could be mineralized as the sole carbon and nitrogen source by FD-1. 2-FA, 2,4-DFA, 3,4-DFA, and 2,3,4-TFA could not be degraded by FD-1, respectively, and were selected as secondary substrates for cometabolism with 500 mg/L 4-FA as growth substrate. Bacterial growth (OD600), F−concentrations, and fluoroanilines contents were measured to determinate the

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3

Wang, Zhi-Xian, Leonard I. Wiebe, Erik De Clercq, Jan Balzarini та Edward E. Knaus. "Syntheses of 4-[1-(2-deoxy-β-D-ribofuranosyl)]-derivatives of 2-substituted-5-fluoroaniline: "cytosine replacement" analogs of deoxycytidine for evaluation as anticancer and antihuman immunodeficiency virus (anti-HIV) agents". Canadian Journal of Chemistry 78, № 8 (2000): 1081–88. http://dx.doi.org/10.1139/v00-105.

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A group of 4-[1-(2-deoxy-β-D-ribofuranosyl)]-derivatives of 5-fluoroaniline possessing a variety of aryl C-2 substituents (6a R = H, 6b R = F, 6c R = Me) were synthesized. Accordingly, a Heck-type coupling reaction of the 4-iodoaniline derivatives (13ac) with the bis(tert-butyldimethylsilyl)glycal (11) in the presence of Pd(OAc)2 and Ph3As, followed by removal of the tert-butyldimethylsilyl protection groups using n-Bu4N+F-, yielded the corresponding 4-(β-D-glycero-pentofuran-3-ulos-1-yl)aniline derivatives (14ac) having a C-3 C=O in the sugar ring. Reduction of the C-3 C=O compounds (14ac)

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4

Hahn, Jennifer, Matthias Krieg, Constanze Keck, Cäcilia Maichle-Mössmer, Reinhold F. Fink, and Holger F. Bettinger. "Thermal dehydrochlorination in the 4-fluoroaniline–trichloroborane system: identification of reactive intermediates involved in the formation of B,B′,B′′-trichloro-N,N′,N′′-tri((4-fluoro)phenyl)borazine." Dalton Transactions 47, no. 48 (2018): 17304–16. http://dx.doi.org/10.1039/c8dt03954b.

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5

Sun, Jiyu, Asia Marie S. Riel, and Orion B. Berryman. "Solvatochromism and fluorescence response of a halogen bonding anion receptor." New Journal of Chemistry 42, no. 13 (2018): 10489–92. http://dx.doi.org/10.1039/c8nj00558c.

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6

Zeller, Matthias, Allen D. Hunter, Jody L. Regula та Paul S. Szalay. "Tricarbonyl(η6-4-fluoroaniline)chromium". Acta Crystallographica Section E Structure Reports Online 59, № 11 (2003): m975—m976. http://dx.doi.org/10.1107/s1600536803021469.

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7

Subashini, Ashokkumar, Kandasamy Ramamurthi та Helen Stoeckli-Evans. "Dichloridobis(4-fluoroaniline-κN)zinc". Acta Crystallographica Section E Structure Reports Online 68, № 9 (2012): m1152. http://dx.doi.org/10.1107/s1600536812033922.

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8

Ram Kumar, A., S. Selvaraj, P. Anthoniammal, et al. "Comparison of spectroscopic, structural, and molecular docking studies of 5-nitro-2-fluoroaniline and 2-nitro-5-fluoroaniline: An attempt on fluoroaniline isomers." Journal of Fluorine Chemistry 270 (August 2023): 110167. http://dx.doi.org/10.1016/j.jfluchem.2023.110167.

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9

Ben Nasr, Mahjouba, Emmanuel Aubert, Enrique Espinosa, Frederic Lefebvre, and Cherif Ben Nasr. "Synthesis and physico-chemical studies of a novel coordination compound ZnCl2(C6H4FNH2)2." JOURNAL OF ADVANCES IN CHEMISTRY 10, no. 3 (2014): 2502–11. http://dx.doi.org/10.24297/jac.v10i3.2292.

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A new Zn(II) complex with the monodentate ligand 3-fluoroaniline, ZnCl2(C6H4FNH2)2, has been prepared and characterized by single crystal X-ray diffraction, Solid state NMR, IR and UV-visible spectroscopies. The Zn(II) ion, located on a special position, is tetracoordinated by two nitrogen atoms of two 3-fluoroaniline monodentate ligands and two chlorine ligands. In the atomic arrangement, the ZnCl2(NH2)2 entities are interconnected via N-H…Cl hydrogen bonds to form inorganic layers parallel to the (b, c) plane. The organic 3-fluorophenyl groups are located between these layers and connect eac

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10

Suchanski, W., P. Minkin, and S. Jurga. "Molecular dynamics in supercooled m -fluoroaniline." Journal of Molecular Structure 559, no. 1-3 (2001): 179–85. http://dx.doi.org/10.1016/s0022-2860(00)00695-5.

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11

Yang, Shih Chang, and Wen Bih Tzeng. "Mass-analyzed threshold ionization spectroscopy of deuterium-substituted isotopomers of o-fluoroaniline and m-fluoroaniline cations." Journal of Molecular Spectroscopy 269, no. 1 (2011): 49–55. http://dx.doi.org/10.1016/j.jms.2011.04.023.

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12

Mishra, A. P., A. Tiwari, S. K. Gupta, and Rajendra Jain. "Synthesis, Spectral and Antimicrobial Studies of Some Co(II), Ni(II) and Cu(II) Complexes Containing 2-Thiophenecarboxaldehyde Moiety." E-Journal of Chemistry 9, no. 3 (2012): 1113–21. http://dx.doi.org/10.1155/2012/585827.

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Some new Schiff base metal complexes of Co(II), Ni(II) and Cu(II) derived from 3-chloro-4-fluoroaniline (HL1) and 4-fluoroaniline (HL2) with 2-thiophenecarboxaldehyde have been synthesized and characterized by elemental analysis, FT-IR, FAB-mass, molar conductance, electronic spectra, ESR and magnetic susceptibility. The complexes exhibit coordination number 4 or 6. The complexes are colored and stable in air. Analytical data revealed that all the complexes exhibited 1:2 (metal: ligand) ratio. FAB-mass data show degradation pattern of the complexes. The Schiff base and metal complexes show a g

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13

Shabalala, Nhlanhla, Suresh Maddila, and Sreekantha B. Jonnalagadda. "Catalyst-free, one-pot, four-component green synthesis of functionalized 1-(2-fluorophenyl)-1,4-dihydropyridines under ultrasound irradiation." New Journal of Chemistry 40, no. 6 (2016): 5107–12. http://dx.doi.org/10.1039/c5nj03574k.

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A catalyst-free synthesis protocol for functionalized 1,4-dihydropyridines under ultrasonic irradiation in aqueous ethanol is reported with excellent yields. Eleven new compounds are synthesized using dimethylacetylenedicarboxylate, 2-fluoroaniline, malononitrile and various substituted aldehydes.

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14

Tzeng, W. B., and J. L. Lin. "Ionization Energy ofp-Fluoroaniline and Vibrational Levels ofp-Fluoroaniline Cation Determined by Mass-Analyzed Threshold Ionization Spectroscopy." Journal of Physical Chemistry A 103, no. 43 (1999): 8612–19. http://dx.doi.org/10.1021/jp992047g.

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15

Steyl, Gideon. "2-(4-Flouroanilino)tropone." Acta Crystallographica Section E Structure Reports Online 63, no. 11 (2007): o4353. http://dx.doi.org/10.1107/s1600536807050271.

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The title compound, C13H10FNO, which was synthesized from the reaction of tosyloxytropone and 4-fluoroaniline, has two independent molecules of similar bond dimensions in the asymmetric unit. Adjacent molecules are linked by hydrogen bonds and C—H...F interactions.

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16

Kepceoğlu, Abdullah, and Yavuz Ekincioğlu. "Theoretical Investigation of the Molecular Properties of the Fluoroaniline and Fluoroanisole Isomers." Düzce Üniversitesi Bilim ve Teknoloji Dergisi 13, no. 1 (2025): 64–94. https://doi.org/10.29130/dubited.1396459.

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This research paper aims to analyse the molecular properties of fluoroaniline and fluoroanisole isomers through a range of theoretical methods. These methods include optimization of molecular structures, conformational analysis, and calculation of nonlinear optics (NLO) properties, frontier molecular orbital (HOMO-1, HOMO/SOMO, LUMO, LUMO+1) energies, chemical reactivity descriptors (ionization potentials - vertical and adiabatic, electron affinity, chemical hardness, softness, and electronegativity), molecular electrostatic potential (MEP), natural bonding orbital (NBO), and UV-Vis spectra. T

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17

Arjuna Gowda, K. V., M. K. Kokila, Puttaraja, M. V. Kulkarni, and N. C. Shivaprakash. "(E)-N-Benzylidene-3-chloro-4-fluoroaniline." Acta Crystallographica Section C Crystal Structure Communications 56, no. 10 (2000): e481-e482. http://dx.doi.org/10.1107/s0108270100012166.

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18

Lee Lin, Jung, and Wen Bih Tzeng. "Ionization energy of o-fluoroaniline and vibrational levels of o-fluoroaniline cation determined by mass-analyzed threshold ionization spectroscopy." Physical Chemistry Chemical Physics 2, no. 17 (2000): 3759–63. http://dx.doi.org/10.1039/b003909h.

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19

Fawcett, John, Fabrizio Sicilia, and Gregory A. Solan. "trans,trans,trans-Diacetonitriledibromobis(4-fluoroaniline)nickel(II)." Acta Crystallographica Section E Structure Reports Online 61, no. 7 (2005): m1256—m1257. http://dx.doi.org/10.1107/s1600536805016995.

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20

Jasinski, Jerry P., Albert E. Pek, C. S. Chidan Kumar, H. S. Yathirajan, and Suresh Kumar. "N-[(2-Chloro-3-quinolyl)methyl]-4-fluoroaniline." Acta Crystallographica Section E Structure Reports Online 66, no. 10 (2010): o2548—o2549. http://dx.doi.org/10.1107/s1600536810036056.

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21

Scholtysik, Clemens, Maximilian Roca Jungfer, Adelheid Hagenbach, and Ulrich Abram. "Reactions of [ReOCl3 (PPh3 )2 ] with 4-Fluoroaniline." Zeitschrift für anorganische und allgemeine Chemie 644, no. 22 (2018): 1451–55. http://dx.doi.org/10.1002/zaac.201800240.

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22

Waware, U. S., Gabriel J. Summers, A. M. S. Hamouda, and Mohd Rashid. "Synthesis and Characterization of Polyaniline, Poly(3-fluoroaniline), and Poly(aniline-co-3-fluoroaniline) Derivatives Obtained by Chemical Oxidative Polymerization Methods." Polymer-Plastics Technology and Engineering 57, no. 10 (2017): 1015–25. http://dx.doi.org/10.1080/03602559.2017.1370108.

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23

Thompson, Ryan, John D. Perry, Stephen P. Stanforth, and John R. Dean. "Detection of Microbial Nitroreductase Activity by Monitoring Exogenous Volatile Organic Compound Production Using HS-SPME-GC-MS." Separations 7, no. 4 (2020): 64. http://dx.doi.org/10.3390/separations7040064.

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Development of a rapid approach for universal microbial detection is required in the healthcare, food and environmental sectors to aid with medical intervention, food safety and environmental protection. This research investigates the use of enzymatic hydrolysis of a substrate by a microorganism to generate a volatile organic compound (VOC). One such enzyme activity that can be used in this context is nitroreductase as such activity is prevalent across a range of microorganisms. A study was developed to evaluate a panel of 51 microorganisms of clinical interest for their nitroreductase activit

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24

Hosten, Eric C., and Richard Betz. "The crystal structure of 2,6-dibromo-4-fluoroaniline, C6H4Br2FN." Zeitschrift für Kristallographie - New Crystal Structures 236, no. 2 (2021): 475–77. http://dx.doi.org/10.1515/ncrs-2020-0557.

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25

Eadsforth, C. V., P. C. Coveney, D. H. Hutson, C. J. Logan, and A. J. Samuel. "The metabolism ofo-fluoroaniline by rats, rabbits and marmosets." Xenobiotica 16, no. 6 (1986): 555–66. http://dx.doi.org/10.3109/00498258609043544.

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26

Sykora, Richard E., Andrew G. Harris, Jason W. Clements та Norris W. Hoffman. "Dichlorido(η6-p-cymene)(4-fluoroaniline-κN)ruthenium(II)". Acta Crystallographica Section E Structure Reports Online 67, № 1 (2010): m99—m100. http://dx.doi.org/10.1107/s1600536810051962.

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27

Grasso, Domenico, Concetta Gandolfo, Salvatore Fasone, and Carmelo La Rosa. "Liquid Crystalline Properties of p-n-alkoxybenzylidene-p-fluoroaniline." Molecular Crystals and Liquid Crystals Science and Technology. Section A. Molecular Crystals and Liquid Crystals 221, no. 1 (1992): 85–91. http://dx.doi.org/10.1080/10587259208037523.

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28

Waware, Umesh Somaji, Mohd Rashid, and A. M. S. Hamouda. "Highly improved AC conductivity of poly(aniline-o-fluoroaniline)." Ionics 25, no. 3 (2018): 1057–65. http://dx.doi.org/10.1007/s11581-018-2665-5.

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29

Grzesiak-Nowak, M., G. Appleby, and W. Łasocha. "Powder diffraction and synchrotron radiation, a powerful tool in the investigation of new compounds: CdBr2(3-fluoroaniline)2and CdBr2(4-fluoroaniline)2." X-Ray Spectrometry 44, no. 5 (2015): 398–403. http://dx.doi.org/10.1002/xrs.2647.

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30

Huang, Kuan-Yeh, Chang-Lung Shiu, Yu-An Su, et al. "Preparation and gas transport properties of dense fluoroaniline copolymer membranes." Journal of Membrane Science 339, no. 1-2 (2009): 171–76. http://dx.doi.org/10.1016/j.memsci.2009.04.046.

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31

Kasper, Gernot, and Andreas Reiser. "A volumetric and dielectric study of m-fluoroaniline under pressure." Journal of Non-Crystalline Solids 352, no. 42-49 (2006): 4900–4904. http://dx.doi.org/10.1016/j.jnoncrysol.2006.02.150.

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32

Feng, Huajun, Yuxiang Liang, Kun Guo, Yuyang Long, Yanqing Cong, and Dongsheng Shen. "Addition of nitrite enhances the electrochemical defluorination of 2-fluoroaniline." Journal of Hazardous Materials 300 (December 2015): 607–14. http://dx.doi.org/10.1016/j.jhazmat.2015.06.071.

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33

Sharma, Amit L., Parveen Kumar, and Akash Deep. "Thermally Evaporated Poly(Aniline-co-Fluoroaniline) Films for Ammonia Sensing." Polymer-Plastics Technology and Engineering 52, no. 7 (2013): 737–42. http://dx.doi.org/10.1080/03602559.2012.762674.

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34

Lichanot, A. "Heat capacities of fluoroaniline, fluorophenol and difluorobenzene in condensed phase." Thermochimica Acta 177 (April 1991): 265–72. http://dx.doi.org/10.1016/0040-6031(91)80103-p.

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35

Xue-Min, Zhou, Wang Qi-Wen, and Ji Ting-Shun. "NMR study of bis-4-fluoroaniline Schiff base of gossypol." Acta Chimica Sinica 4, no. 2 (1986): 150–53. http://dx.doi.org/10.1002/cjoc.19860040208.

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36

Vervoort, J., I. M. C. M. Rietjens, C. T. W. Moonen, M. Von Kienlin, and D. Despres. "Biotransformation of 2-fluoroaniline in rats studied byIn Vivo19F NMR." NMR in Biomedicine 4, no. 6 (1991): 255–61. http://dx.doi.org/10.1002/nbm.1940040602.

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37

Gök, Ayşegül, Beki̇r Sari, and Muzaffer Talu. "Preparation and characterization of polyfuran/poly(2-fluoroaniline) conducting composites." Journal of Polymer Science Part B: Polymer Physics 42, no. 18 (2004): 3359–67. http://dx.doi.org/10.1002/polb.20195.

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38

Sharma, Amit L., Vibha Saxena, S. Annapoorni, and B. D. Malhotra. "Synthesis and characterization of a copolymer: Poly(aniline-co-fluoroaniline)." Journal of Applied Polymer Science 81, no. 6 (2001): 1460–66. http://dx.doi.org/10.1002/app.1572.

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39

Pang, Yan, and Zhong Wei Wang. "Analysis on Health Risk of Extractives of Cinnamomum camphora by Py-GC-MS." Key Engineering Materials 480-481 (June 2011): 242–45. http://dx.doi.org/10.4028/www.scientific.net/kem.480-481.242.

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In order to evaluate its potential health risk to food, Py-GC/MS was used to analyze the high-grade resource recovery of benzene/ethanol extractives of the Cinnamomum camphora wood. Relative content of each component was determined by area normalization. The main constituents were hexadecanoic acid, oleic Acid, octadecanoic acid, 4-chloro-2-fluoroaniline, cyclohexane, 1,1-dimethyl-, 7-heptadecene, 17-chloro-, brucine, ergosta-4,6,22-trien-3.beta.-ol, etc. So the benzene/ethanol extractives of Cinnamomum camphora could be used as materials of biomedicine.

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40

Schaefer, Ted, and Glenn H. Penner. "Six-bond 1H,1H and 1H,19F spin coupling constants as indicators of geometry in aniline and p-fluoroaniline." Canadian Journal of Chemistry 63, no. 8 (1985): 2253–55. http://dx.doi.org/10.1139/v85-371.

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The long-range coupling constants between amino protons and the ring proton or fluorine nucleus in the para position of aniline and p-fluoroaniline imply that, in benzene solution, the geometry at the amino group is very similar in the two compounds. The ratio of the two coupling constants is consistent with potential functions for inversion at nitrogen derived from far infrared data, but inconsistent with microwave spectra which indicate that the angle defining the intersection of the amino and benzene planes differs by 9° in these two compounds.

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41

Rahim, Mohamad, Leila Ghannam, Rodolfe Antoine, et al. "Structure and permanent electric dipole of para-fluoroaniline in gaseous phase." Open Chemistry 11, no. 3 (2013): 325–29. http://dx.doi.org/10.2478/s11532-012-0179-y.

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AbstractAbstract By coupling a matrix assisted laser desorption source to an electric beam deflection setup, we have measured the permanent electric dipole moment of the isolated para-fluroaniline PFAN (FC6H4NH2) molecule in the ground state. This measurement of the electric dipole of an isolated push-pull molecule is unique. The experimental value is compared to two different calculations and the structure of the system is discussed. Graphical abstract

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42

Favero, L. B., P. Moreschini, W. Caminati, M. Becucci, I. López-Tocón, and G. Pietraperzia. "Large amplitude motions in the electronic ground state of 4-fluoroaniline." Physical Chemistry Chemical Physics 2, no. 7 (2000): 1351–55. http://dx.doi.org/10.1039/b000180p.

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43

Dave, Jayrang S., Purvang D. Patel, and Himanshu Bhatt. "Synthesis and Mesomorphic Characteristics of Fluoroaniline Derivatives with Different Lateral Groups." Molecular Crystals and Liquid Crystals 562, no. 1 (2012): 76–84. http://dx.doi.org/10.1080/10426507.2012.669678.

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44

Lin, J. L., K. C. Lin, and W. B. Tzeng. "Species-Selected Mass-Analyzed Threshold Ionization Spectra of m-Fluoroaniline Cation." Applied Spectroscopy 55, no. 2 (2001): 120–24. http://dx.doi.org/10.1366/0003702011951632.

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45

Padmanabhan, V. M., R. P. Patel, and T. N. Ranganathan. "Structure of trans-dichlorobis(p-fluoroaniline)palladium(II), [PdCl2(C6H6FN)2]." Acta Crystallographica Section C Crystal Structure Communications 41, no. 9 (1985): 1305–7. http://dx.doi.org/10.1107/s0108270185007545.

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46

Wang, Xiao-Yang, Yu-Lu Wang, Zi-Yi Zhang, et al. "The Improved Method of Oxidation of 4-Fluoroaniline to 4-Fluoroazobenzene." Synthetic Communications 29, no. 3 (1999): 481–85. http://dx.doi.org/10.1080/00397919908085790.

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47

Cutroni, M., A. Mandanici, and A. Piccolo. "The dielectric relaxation behaviour of m-fluoroaniline above the glass transition." Journal of Physics: Condensed Matter 7, no. 34 (1995): 6781–88. http://dx.doi.org/10.1088/0953-8984/7/34/003.

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48

Kang, Dong-Pil, and Mun-Soo Yun. "Chemical polymerization of 2-chloroaniline and 2-fluoroaniline by chromic acid." Synthetic Metals 29, no. 1 (1989): 343–48. http://dx.doi.org/10.1016/0379-6779(89)90316-0.

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49

Hwang, Hyun Tae, Joseph R. Martinelli, Rajamani Gounder, and Arvind Varma. "Kinetic study of Pd-catalyzed hydrogenation of N-benzyl-4-fluoroaniline." Chemical Engineering Journal 288 (March 2016): 758–69. http://dx.doi.org/10.1016/j.cej.2015.12.006.

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50

Betz, R. "Crystal and molecular structure of 2,6-dibromo-3-chloro-4-fluoroaniline." Crystallography Reports 60, no. 7 (2015): 1049–52. http://dx.doi.org/10.1134/s1063774515070056.

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