PENTAFLUOROBENZENE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6HF5
Molecular Weight	168.0642
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=WACNXHCZHTVBJM-UHFFFAOYSA-N

InChI=1S/C6HF5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H

HIDE SMILES / InChI

Molecular Formula	C6HF5
Molecular Weight	168.0642
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Computational study of the sulfonylated amino acid hydroxamates binding to the zinc ion within the active site of carbonic anhydrase.	2009-02	19108582
A simple base-mediated halogenation of acidic sp2 C-H bonds under noncryogenic conditions.	2009-01-15	19102661
Simultaneous determination of main taxoids in Taxus needles extracts by solid-phase extraction-high-performance liquid chromatography with pentafluorophenyl column.	2009-01	18816506
Structure-activity relationship of novel and known inhibitors of human dimethylarginine dimethylaminohydrolase-1: alkenyl-amidines as new leads.	2008-12-15	19013076
On the presence or absence of geminal Si...N interactions (alpha-effect) in pentafluorophenylsilyl compounds with SiCN, SiNN and SiON backbones.	2008-11-07	18854904
The effects of volatile aromatic anesthetics on voltage-gated Na+ channels expressed in Xenopus oocytes.	2008-11	18931215
Carbonic anhydrase inhibitors: synthesis and inhibition studies against mammalian isoforms I-XV with a series of 2-(hydrazinocarbonyl)-3-substituted-phenyl-1H-indole-5-sulfonamides.	2008-10-15	18819811
Iridium derivatives of fluorinated aromatics by C-H activation: isolation of classical and non-classical hydrides.	2008-10-14	18813374
Synthesis of binuclear platinum complexes containing the ligands 8-naphthyridine, 2-aminopyridine, and 7-azaindolate. An experimental study of the steric hindrance of the bulky pentafluorophenyl ligands in the synthesis of binuclear complexes.	2008-10-06	18767797
Regiospecifically alpha-13C-labeled porphyrins for studies of ground-state hole transfer in multiporphyrin arrays.	2008-09-19	18722412
Rhodium-catalyzed substitution reaction of aryl fluorides with disulfides: p-orientation in the polyarylthiolation of polyfluorobenzenes.	2008-09-17	18722437
Vapochromic behavior of {Ag2(Et2O)2[Au(C6F5)2]2}n with volatile organic compounds.	2008-09-15	18693679
Tuning the electronic structure of diboradiferrocenes.	2008-09-07	18698455
Synthesis and elastase-inhibiting activity of 2-pyridinyl-isothiazol-3(2H)-one 1,1-dioxides.	2008-09-01	18701300
[C-terminal fragment of ribosomal protein S15 is located at the decoding site of the human ribosome].	2008-07-10	18610839
A novel approach to the synthesis of 6-substituted uracils in three-step, one-pot reactions.	2008-06-20	18489150
Synthesis and solid-state structure of perfluorophenyl end-capped polyynes.	2008-06-05	18457403
Scope and limitations of the SCS-MP2 method for stacking and hydrogen bonding interactions.	2008-05-21	18464991
Through-space interactions between parallel-offset arenes at the van der Waals distance: 1,8-diarylbiphenylene syntheses, structure and QM computations.	2008-05-21	18464983
Mixed-mode chromatography for fractionation of peptides, phosphopeptides, and sialylated glycopeptides.	2008-05-16	18281053
Optimization of separation in two-dimensional high-performance liquid chromatography by adjusting phase system selectivity and using programmed elution techniques.	2008-05-02	18067903
Structural versatility of anion-pi interactions in halide salts with pentafluorophenyl substituted cations.	2008-04-09	18336029
Total synthesis and initial structure-activity relationships of longicatenamycin A.	2008-04	18246567
Structure-property relationships of fluorinated donor/acceptor tetrakis(phenylethynyl)benzenes and bis(dehydrobenzoannuleno)benzenes.	2008-03-21	18278934
Validation of a solid-phase extraction and liquid chromatography-electrospray tandem mass spectrometric method for the determination of nine basic pharmaceuticals in wastewater and surface water samples.	2008-02-29	18237738
Routes to new hafnium(IV) tetraaryl porphyrins and crystal structures of unusual phosphate-, sulfate-, and peroxide-bridged dimers.	2008-01-21	18088113
New and efficient arrays for photoinduced charge separation based on perylene bisimide and corroles.	2008	17926309
Conformational consequences of protein glycosylation: preparation of O-mannosyl serine and threonine building blocks, and their incorporation into glycopeptide sequences derived from alpha-dystroglycan.	2008	17868094
Trapped inorganic phosphate dimer.	2007-12-28	18060146
Fluorinated diphenylpolyenes: crystal structures and emission properties.	2007-12-27	18052354
Structural, spectroscopic, and electrochemical properties of a series of high-spin thiolatonickel(II) complexes.	2007-12-24	18001122
Development of Tyrocidine A analogues with improved antibacterial activity.	2007-11-01	17728134
Infrared spectroscopy of anionic hydrated fluorobenzenes.	2007-09-21	17887841
Photoderivatized polymer thin films at quartz crystal microbalance surfaces: sensors for carbohydrate-protein interactions.	2007-09-15	17705448
Exploration of the binding mode of indanesulfonamides as selective inhibitors of human carbonic anhydrase type VII by targeting Lys 91.	2007-09	17607683
Development of perfluoroarene-arene interactions for macrocyclic en-yne metathesis and the total synthesis of macrocyclic natural products.	2007-08-17	17636956
Comparison of reversed-phase liquid chromatography-mass spectrometry with electrospray and atmospheric pressure chemical ionization for analysis of dietary tocopherols.	2007-07-20	17512939
Chromatographic classification and comparison of commercially available reversed-phase liquid chromatographic columns containing phenyl moieties using principal component analysis.	2007-06-22	17462664
Theoretical investigation of in-plane hydrogen-bonded complexes of ammonia with partially substituted fluorobenzenes.	2007-04-12	17388393
Ruthenium(II) complexes with improved photophysical properties based on planar 4'-(2-pyrimidinyl)-2,2':6',2' '-terpyridine ligands.	2007-04-02	17302410
Highly potent 3-pyrroline mechanism-based inhibitors of bovine plasma amine oxidase and mass spectrometric confirmation of cofactor derivatization.	2007-02-15	17150363
Pi-Pi complexation of bupivacaine and analogues with aromatic receptors: implications for overdose remediation.	2007	18019843
Structural studies of gold(I, II, and III) compounds with pentafluorophenyl and tetrahydrothiophene ligands.	2007	17328088
New synthesis of beta-sultams from pentafluorophenyl sulfonates.	2006-11-23	17107060
Mild and general conditions for the cross-coupling of aryl halides with pentafluorobenzene and other perfluoroaromatics.	2006-10-26	17048852
Activation of pentafluorophenylsilanes by weak Lewis bases in reaction with iminium cations.	2006-09-15	16958514
Carbonic anhydrase inhibitors. N-cyanomethylsulfonamides--a new zinc binding group in the design of inhibitors targeting cytosolic and membrane-anchored isoforms.	2006-08	17059184
Interactions of a fluoroaryl surfactant with hydrogenated, partially fluorinated, and perfluorinated surfactants at the air/water interface.	2006-07-18	16831005
2,2',3,3',4,4',5,5',6,6'-Decafluorodiphenylamine and its 1:1 cocrystal with diphenylamine.	2006-07	16823219
Photodissociation dynamics of C6HxF6-x (x = 1-4) at 193 nm.	2005-05-05	16851978

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:53:31 GMT 2025` Edited by `admin` on `Mon Mar 31 18:53:31 GMT 2025`
Record UNII	IH36LU53XS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PENTAFLUOROBENZENE

Systematic Name

English

NSC-88293

Preferred Name

English

BENZENE, 1,2,3,4,5-PENTAFLUORO-

Systematic Name

English

BENZENE, PENTAFLUORO-

Systematic Name

English

1,2,3,4,5-PENTAFLUOROBENZENE

Systematic Name

English

Code System Code Type Description

PUBCHEM

9696