Hexafluorbenzol

Hexafluorobenzene

HCID 9805CAS 392-56-3
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Grundinformationen

Standard-SMILES
Fc1c(F)c(F)c(F)c(F)c1F
InChIKey
ZQBFAOFFOQMSGJ-UHFFFAOYSA-N
Summenformel
C6.F6
Durchschnittliche Molmasse
186,05 g/mol
Monoisotopische Masse
185,99041932

Überblick

Hexafluorobenzene is a member of the class of fluorobenzenes that is benzene in which all six hydrogen atom have been replaced by fluorine. It has a role as a NMR solvent. It is a member of fluorobenzenes and a fluorocarbon.

Namen und Bezeichner

Bevorzugter Name
Hexafluorobenzene
IUPAC
1,2,3,4,5,6-hexafluorobenzene
Lokaler Name
Hexafluorbenzol
Englischer Name
hexafluorobenzene
Summenformel
C6F6
Molmasse
186.05

Namen und Synonyme

HEXAFLUOROBENZENE392-56-3Perfluorobenzene1,2,3,4,5,6-HexafluorobenzeneCP 28CMC18T611KNSC-21628DTXSID5043924CHEBI:38589RefChem:786088DTXCID3023924206-876-2
Weitere Namen anzeigen
CP281,2,3,4,5,6-hexafluoro-benzenehexafluoro-benzenHexaflurorobenzenebenzene,hexafluoro-Perfluorobenzene 99%
Benzene, hexafluoro-C6F6Hexafluorbenzolhexafluoro benzeneMFCD00000288NSC 21628HEXAFLUOROBENZENE [MI]AKOS000120141

Datenbank-Bezeichner

CAS
392-56-3
PubChem CID
9805
DTXSID
DTXSID5043924
ChEBI
CHEBI:38589
UNII
CMC18T611K
EC Number
206-876-2
Nikkaji
J37.679E

Eigenschaften

Berechnete Struktureigenschaften

XLogP
2,5
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
6
Frei drehbare Bindungen
0
Schwere Atome
12

Experimentelle und physikochemische Eigenschaften

Chemical ClassesOther Classes -> Halogenated Monoaromatics
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
LogP2.22
Density1.61 @ 20°C
Vapor Pressure84.5 [mmHg]
Physical DescriptionLiquid; [Hawley] Colorless clear liquid; Melting point = 3.7-41 deg C; [MSDSonline]

Physikochemische Eigenschaften

Schmelzpunkt
3.7 · 3.7-4.1 °C (lit.)
Siedepunkt
80 · 80-82 °C (lit.)
Dichte
1.612 g/mL · 1.612 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.377(lit.)
Flammpunkt
50 °F · 50 °F
storage temp.
Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P264+P265, P280, P303+P361+P353, P305+P351+P338, P337+P317, P370+P378, P403+P235, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 76 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory InformationBenzene, hexafluoro-: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryAn irritant; [MSDSonline] See Hexachlorobenzene.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)

Sicherheit und Schutzausrüstung

Protective Action Criteria (PAC) · 3 Einträge

50 [mg/m3]

550 [mg/m3]

3300 [mg/m3]

Toxikologische Informationen

Toxicity DataLC50 (mice) = 95,000 mg/m3/2h

Sicherheitsdaten

F
10
wgk
3
tsca
TSCA listed
ridadr
UN 1993 3/PG 2
hs_code
29039990
RTECS-Nr.
DA3050000

Chemie und Industrie

Verwendung und Herstellung

UsesUsed as solvent and for chemical synthesis; [Merck Index] Used as solvent in NMR spectroscopy; [Hawley]
General Manufacturing InformationBenzene, 1,2,3,4,5,6-hexafluoro-: ACTIVE
Anwendungen · 2 Einträge

BeschreibungHexafluorobenzene, HFB, C6F6, or perfluorobenzene is an organic, aromatic compound. In this derivative of benzene all hydrogen atoms have been replaced by fluorine atoms. The technical uses of the compound are limited, although it is recommended as a solvent in a number of photochemical reactions. In the laboratory hexafluorobenzene is used as standard in fluorine-19 NMR spectroscopy, solvent and standard in carbon-13 NMR, solvent in proton NMR, solvent when studying some parts in the infrared and solvent in ultraviolet–visible spectroscopy, as hexafluorobenzene itself hardly shows any absorbance in the UV region.

VerwendenHexafluorobenzene is used as a solvent in photochemical reactions. It is also used as a reference compound in fluorine-19 NMR, carbon-13 NMR. It is used as a solvent in proton NMR, IR spectrum and UV-spectra. It is used as anticorrosive, antifriction and anti-tumor agents. Further, it is used as a reference molecule to investigate tissue oxygenation in vivo studies. It forms series of 1:1 complexes with naphthalene, anthracene, phenanthrene, pyrene and triphenylene.

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海淖沁生物科技有限公司400-1125320 13774248860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Ergänzende Hinweise

DefinitionChEBI: A member of the class of fluorobenzenes that is benzene in which all six hydrogen atom have been replaced by fluorine.

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