Perfluorobenzene

Names

[ CAS No. ]:
392-56-3

[ Name ]:
Perfluorobenzene

[Synonym ]:
Benzene, 1,2,3,4,5,6-hexafluoro-
Hexafluorobenzene
MFCD00000288
EINECS 206-876-2
C6F6
Perfluorobenzene

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
80.5±35.0 °C at 760 mmHg

[ Melting Point ]:
3.7-4.1 °C(lit.)

[ Molecular Formula ]:
C₆F₆

[ Molecular Weight ]:
186.055

[ Flash Point ]:
10.0±0.0 °C

[ Exact Mass ]:
185.990417

[ LogP ]:
2.42

[ Vapour Pressure ]:
94.5±0.1 mmHg at 25°C

[ Index of Refraction ]:
1.374

[ Storage condition ]:
Flammables area

[ Stability ]:
Stable. Incompatible with strong oxidizing agents. May form complexes with transition metals which can explode when heated. Highly flammable.

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DA3050000

CHEMICAL NAME :: Benzene, hexafluoro-

CAS REGISTRY NUMBER :: 392-56-3

LAST UPDATED :: 199710

DATA ITEMS CITED :: 7

MOLECULAR FORMULA :: C6-F6

MOLECULAR WEIGHT :: 186.06

WISWESSER LINE NOTATION :: FR BF CF DF EF FF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >25 gm/kg

TOXIC EFFECTS :: Behavioral - excitement Gastrointestinal - hypermotility, diarrhea Nutritional and Gross Metabolic - weight loss or decreased weight gain

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0571186

TYPE OF TEST :: LC50 - Lethal concentration, 50 percent kill

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 95 gm/m3/2H

TOXIC EFFECTS :: Lungs, Thorax, or Respiration - respiratory depression Lungs, Thorax, or Respiration - other changes

REFERENCE :: IZSBAI Izvestiya Sibirskogo Otdeleniya Akademii Nauk SSSR, Seriya Biologomeditsinskikh Nauk. (Novosibirsk, USSR) No.1-3, 1963-68. For publisher information, see ISBNBN. Volume(issue)/page/year: 3,91,1965

TYPE OF TEST :: LCLo - Lowest published lethal concentration

ROUTE OF EXPOSURE :: Inhalation

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 11800 ppm/4H

TOXIC EFFECTS :: Sense Organs and Special Senses (Eye) - lacrimation Behavioral - ataxia Lungs, Thorax, or Respiration - other changes

REFERENCE :: NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: OTS0571186 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-RUSSIA:STEL 5 mg/m3 JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84193 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 41 (estimated)

Safety Information

[ Symbol ]:

GHS02

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H225

[ Precautionary Statements ]:
P210

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
F:Flammable

[ Risk Phrases ]:
R11;R36/37/38

[ Safety Phrases ]:
S16-S33-S7/9

[ RIDADR ]:
UN 1993 3/PG 2

[ WGK Germany ]:
3

[ RTECS ]:
DA3050000

[ Packaging Group ]:
II

[ Hazard Class ]:
3

[ HS Code ]:
2903999090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

fluorotribromomethane
hexafluoro-2,5-cyclohexadienylene 1,4-bis(fluorosulfate)
4-chlorohexafluoro-2,5-cyclohexadienyl fluorosulfate
1,2,3,3,4,5,6,6-octafluorocyclohexa-1,4-diene
1,2,3,4,5,5,6,6-Octafluoro-1,3-cyclohexadiene
Bicyclo(2.2.0)hexa-2,5-diene, 1,2,3,4,5,6-hexafluoro-
1H,4H/2H-nonafluorocyclohexane
1H-heptafluorocyclohexa-1,3-diene
1,2,3,4,5,6,7,7-octafluorobicyclo[2.2.1]hepta-2,5-diene

DownStream

1-Chloro-2,3,4,5,6-pentafluorobenzene
benzene, 1,3-dichlorotetrafluoro-
1,2,3,5-Tetrachloro-4,6-difluorobenzene
Benzene,1,3,5-trichloro-2,4,6-trifluoro-
1,2,4,5-Tetrafluorobenzene
tetrafluorobenzene
Pentafluorobenzene
1,2,3-Trifluorobenzene
1,4-Difluorobenzene
1,2,4-Trifluorobenzene

Customs

[ HS Code ]: 2903999090

[ Summary ]:
2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Articles

Gas chromatography with parallel hard and soft ionization mass spectrometry.

Rapid Commun. Mass Spectrom. 29(1) , 91-9, (2014)

Mass spectrometric identification of compounds in chromatography can be obtained from molecular masses from soft ionization mass spectrometry techniques such as field ionization (FI) and fragmentation...

Oxidative dehalogenation of perhalogenated benzenes by cytochrome P450 compound I.

Biochemistry 46(20) , 5924-40, (2007)

Resolution of the identity PBE (RI-PBE) and B3LYP density functional theory calculations are used to understand the cytochrome P450-catalyzed, Compound I-mediated oxidation of perchlorobenzenes, perfl...

The pH-dependence of organofluorine binding domain preference in dissolved humic acid.

Chemosphere 90(2) , 270-5, (2013)

In this study we explore the relationship between solution pH and the distribution of the binding interactions at different domains of a dissolved humic acid (HA) for three xenobiotics: pentafluoroani...

Perfluorobenzene-1,2-diol
Perfluorobenzene-1,3-diol
4-Iodo-1H-perfluorobenzene
1-Chloro-3H-perfluorobenzene
1,4-Bis(pentafluorothio)perfluorobenzene
(1,1,2,3,3,3-Hexafluoropropoxy)-perfluorobenzene
N2,N2,1-Trimethyl-1H-benzo[d]imidazole-2,6-diamine
4-(tert-butyl)-N-(2-oxo-2-(2-phenylmorpholino)ethyl)benzamide
6-(2,6-Dichlorophenyl)-2-(3,4-dimethoxyphenylamino)-8-ethyl-8H-pyrido[2,3-d]pyrimidin-7-one
N1-(5-methylisoxazol-3-yl)-N2-(2-oxo-2-(2-phenylmorpholino)ethyl)oxalamide
4-Ethanesulfonamido-3-methylbenzoic acid
Potassium;iron(3+);hexahydroxide;disulfate
5-(Trimethylsilyl)pent-4-ynylmagnesium chloride
(2E,4E,6Z,8E)-3,7-dimethyl-8-(3-phenyl-2-propan-2-ylcyclohex-2-en-1-ylidene)octa-2,4,6-trienoic acid
1-{4-[8-Amino-1-(2-phenyl-quinolin-7-yl)-imidazo[1,5-a]pyrazin-3-ylmethyl]-piperidin-1-yl}-2-dimethylamino-ethanone
N-((1-isopropylpiperidin-4-yl)methyl)-2-methylbenzamide

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