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Details

Stereochemistry ACHIRAL
Molecular Formula C6F6
Molecular Weight 186.0546
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXAFLUOROBENZENE

SMILES

FC1=C(F)C(F)=C(F)C(F)=C1F

InChI

InChIKey=ZQBFAOFFOQMSGJ-UHFFFAOYSA-N
InChI=1S/C6F6/c7-1-2(8)4(10)6(12)5(11)3(1)9

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
19F MRI of 3D CEM cells to study the effects of tocopherols and tocotrienols.
2010-11-02
Inhibition of human alpha4beta2 neuronal nicotinic acetylcholine receptors by volatile aromatic anesthetics depends on drug hydrophobicity.
2010-02-01
Orientational mechanisms in liquid crystalline systems. 2. The contribution to solute ordering from the reaction field interaction between the solute electric quadrupole moment and the solvent electric field gradient.
2010-01-14
Carbene reactivity of 4-diazo-4H-imidazoles toward nucleophiles and aromatic compounds.
2009-12-18
Dispersion-oriented soft interaction in a frustrated Lewis pair and the entropic encouragement effect in its formation.
2009-12-14
Aromatic C-F activation by complexes containing the {Pt2S2} core via nucleophilic substitution: a combined experimental and theoretical study.
2009-08-14
Photoelectron spectroscopic and theoretical studies of M(m)C(6)F(5) anionic complexes (M = Pb and Bi; m = 1-4).
2009-07-16
Quantum theory atoms in molecules charge-charge flux-dipole flux models for the infrared intensities of benzene and hexafluorobenzene.
2009-07-09
The effect of perfluorination on the aromaticity of benzene and heterocyclic six-membered rings.
2009-06-18
Phase equilibria in ionic liquid-aromatic compound mixtures, including benzene fluorination effects.
2009-05-28
Perfluoroaryltetrahedranes: tetrahedranes with extended sigma-pi conjugation.
2009-03-11
Rapid monitoring of oxygenation by 19F magnetic resonance imaging: Simultaneous comparison with fluorescence quenching.
2009-03
Catalytic hydrodefluorination of aromatic fluorocarbons by ruthenium N-heterocyclic carbene complexes.
2009-02-11
Transient complex formation in CO2-hexafluorobenzene mixtures: a combined raman and ab initio investigation.
2009-01-08
The two structures of the hexafluorobenzene radical cation C6F6(*+).
2009
The effects of volatile aromatic anesthetics on voltage-gated Na+ channels expressed in Xenopus oocytes.
2008-11
Rhodium-catalyzed substitution reaction of aryl fluorides with disulfides: p-orientation in the polyarylthiolation of polyfluorobenzenes.
2008-09-17
Substituent effects in the benzene dimer are due to direct interactions of the substituents with the unsubstituted benzene.
2008-08-20
C-F activation of fluorinated arenes using NHC-stabilized nickel(0) complexes: selectivity and mechanistic investigations.
2008-07-23
The effects of aromatic anesthetics on dorsal horn neuronal responses to noxious stimulation.
2008-06
Scope and limitations of the SCS-MP2 method for stacking and hydrogen bonding interactions.
2008-05-21
Ab initio study of substituent effects in the interactions of dimethyl ether with aromatic rings.
2008-05-21
Influence of solvent on carbene intersystem crossing rates.
2008-05-21
Ultrafast nonradiative dynamics in electronically excited hexafluorobenzene by femtosecond time-resolved mass spectrometry.
2008-04-28
Ab initio study of the interaction of CHX3 (X = H, F, Cl, or Br) with benzene and hexafluorobenzene.
2008-04-10
Quantitative study of interactions between oxygen lone pair and aromatic rings: substituent effect and the importance of closeness of contact.
2008-01-18
Enantioselective synthesis of [7]helicene: dramatic effects of olefin additives and aromatic solvents in asymmetric olefin metathesis.
2008
Comparative study on the structural, optical, and electrochemical properties of bithiophene-fused benzo[c]phospholes.
2008
Revealing the way of self-complementary dimerization for a shape-persistent macrocycle using density functional theory calculations.
2007-12-20
Ultrafast study of 9-diazofluorene: direct observation of the first two singlet states of fluorenylidene.
2007-11-07
Photoelectron spectroscopy of hydrated hexafluorobenzene anions.
2007-09-21
Rigid-rod anion-pi slides for multiion hopping across lipid bilayers.
2007-09-21
2D multinuclear NMR, hyperpolarized xenon and gas storage in organosilica nanochannels with crystalline order in the walls.
2007-07-11
1H and 19F nuclear magnetic resonance microimaging of water and chemical distribution in soil columns.
2007-07
Effect of hexafluorobenzene on the photophysics of pyrene.
2007-06-14
Don't be so BOLD: potential limitations in the use of BOLD MRI for studies of renal oxygenation.
2007-06
On the effect of 1,4-diazabicyclo[2.2.2]octane on the singlet-oxygen dimol emission: photosensitized generation of (1O2)2.
2007-05-24
Oxidative dehalogenation of perhalogenated benzenes by cytochrome P450 compound I.
2007-05-22
NMR and IR study of fluorobenzene and hexafluorobenzene adsorbed on alumina.
2007-05-08
Dual cation and anion acceptor molecules. The case of the (eta6-C6H6)(eta6C6F6)Cr0 complex.
2007-04-26
A highly sensitive biocompatible spin probe for imaging of oxygen concentration in tissues.
2007-04-15
Hexafluorobenzene acts in the spinal cord, whereas o-difluorobenzene acts in both brain and spinal cord, to produce immobility.
2007-04
Van der Waals complexes of small molecules with benzenoid rings: influence of multipole moments on their mutual orientation.
2007-03-22
Correlation of radiation response with tumor oxygenation in the Dunning prostate R3327-AT1 tumor.
2007-03-15
New solvents for cellulose: dimethyl sulfoxide/ammonium fluorides.
2007-03-08
Stabilisation energy of C(6)H(6)...C(6)X(6) (X = F, Cl, Br, I, CN) complexes: complete basis set limit calculations at MP2 and CCSD(T) levels.
2007-02-14
Structure of hydrophobic hydration of benzene and hexafluorobenzene from first principles.
2007-02-08
Towards the design of neutral molecular tweezers for anion recognition.
2007
Substituent effects in C6F6-C6H5X stacking interactions.
2006-12-08
[Photocatalytic degradation of hexafluorobenzene by tungstophosphoric acid].
2006-08
Patents
Name Type Language
HEXAFLUOROBENZENE
MI  
Systematic Name English
NSC-21628
Preferred Name English
HEXAFLUOROBENZENE [MI]
Common Name English
1,2,3,4,5,6-HEXAFLUOROBENZENE
Systematic Name English
PERFLUOROBENZENE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID5043924
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
PUBCHEM
9805
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
MERCK INDEX
m5992
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY Merck Index
ECHA (EC/EINECS)
206-876-2
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
NSC
21628
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
WIKIPEDIA
HEXAFLUOROBENZENE
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
MESH
C003005
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
FDA UNII
CMC18T611K
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
CAS
392-56-3
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY
CHEBI
38589
Created by admin on Mon Mar 31 21:11:10 GMT 2025 , Edited by admin on Mon Mar 31 21:11:10 GMT 2025
PRIMARY