Trifluoroethylene
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Trifluoroethylene
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CAS No:
359-11-5
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Formula:
C2HF3
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Chemical Name:
Trifluoroethylene
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Synonyms:
Ethene,1,1,2-trifluoro-;Ethylene,trifluoro-;Ethene,trifluoro-;1,1,2-Trifluoroethene;Trifluoroethylene;1,1,2-Trifluoroethylene;Trifluoroethene;Ethylene trifluoride;HFC 1123;R 1123;F 1123;HFO 1123
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CAS No:
Trifluoroethylene Basic Attributes
82.025
82.02
206-626-2
Z2866M3Z1A
DTXSID4059887
Colorless gas
2903399090
Characteristics
0
1.16 (est)
1.27 g/cm3
-78 °C
-51 °C
1.26
In water, 1.33X10+4 mg/L at 25 deg C (est)
7.5X10+3 mm Hg at 25 deg C (est)
TCLo ihl-mus: 2,000,000 mg/m3/2H VCVGH*-,288,1990
Henry's Law constant = 0.430 atm-cu m/mol at 25 °C (est)
Hydroxyl radical reaction rate constant = 8.05X10-13 cu cm/molec-sec at 25 °C (est)|Ozone radical reaction rate constant = 0.430 atm-cu m/mol at 25 °C (est)
Safety Information
UN 3161
3
R11
16-33
F,F+
P210-P410 + P403
H220-H280
Reaction with the lighter divalent metals may give much more reactive materials analogous to Grignard reagents. /Haloalkanes/
Toxicity
... Exposure of rats to trifluoroethene (TFE) (0.5%, v/v) or a mixture of TFE and isoflurane (0.5% each) in oxygen for 60 min resulted in plasma fluoride increased over that in nonexposed or isoflurane (0.5%)-exposed animals. In untreated rats plasma fluoride levels following TFE and TFE-isoflurane exposures were approximately equal. In rats treated with phenobarbital, however, isoflurane increased plasma fluoride over two times that in rats exposed to TFE alone. Likewise cytochrome P450 levels declined 24% in TFE-exposed animals and 64% in rats exposed to TFE-isoflurane. The ability of microsomes from fluorocarbon-exposed animals to metabolize (R)- and (S)-warfarin indicates that TFE exposure inactivated the phenobarbital-inducible isozymes P450IIB1, P450IIC6, and P450IIIA to approximately equal degrees (21-35%). TFE-isoflurane exposure further inhibited P450IIB1 and PB450IIC6 to 50-70%, but had only a minor effect on P450IIIA activity. These data demonstrate that the defluorination of TFE in vivo by the phenobarbital-inducible cytochrome P450 isozymes is increased by isoflurane, and that isoflurane enhances the ability of TFE to inactivate cytochromes P450 in an isozyme-selective manner.
Trifluoroethene's production and use as a chemical intermediate(1), may result in its release to the environment through various waste streams(SRC).|Reductive dechlorination via hydrogenolysis of 1,1,2-trichloro-1,2,2-trifluoroethane in sewage sludge and aquifer sediment microcosms following 177 days incubation led to the formation of trifluoroethene as an end product(1).
TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 61(SRC), determined from a structure estimation method(2), indicates that trifluoroethene is expected to have high mobility in soil(SRC). Volatilization of trifluoroethene from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 0.43 atm-cu m/mole(SRC), using a fragment constant estimation method(3). Trifluoroethene is expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 7.5X10+3 mm Hg at 25 °C(SRC), determined from a fragment constant method(4). Highly chlorinated/fluorinated compounds are not expected to biodegrade rapidly(5).|AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 61(SRC), determined from a structure estimation method(2), indicates that trifluoroethene is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 0.43 atm-cu m/mole(SRC), developed using a fragment constant estimation method(4). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 3 hours and 4 days, respectively(SRC). According to a classification scheme(5), an estimated BCF of 3(SRC), from an estimated log Kow of 1.16(6) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is low(SRC). Highly chlorinated/fluorinated compounds are not expected to biodegrade rapidly(8).|ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), trifluoroethene, which has an estimated vapor pressure of 7.5X10+3 mm Hg at 25 °C(SRC), determined from a fragment constant method(2), is expected to exist solely as a gas in the ambient atmosphere. Gas-phase trifluoroethene is degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC); the half-life for this reaction in air is estimated to be 20(SRC), calculated from its rate constant of 8.1X10-13 cu cm/molecule-sec at 25 °C(SRC) that was derived using a structure estimation method(3). Trifluoroethene has an atmospheric lifetime of 250 years(4). Trifluoroethene does not contain chromophores that absorb at wavelengths >290 nm(5), and therefore is not expected to be susceptible to direct photolysis by sunlight(SRC).
The rate constant for the vapor-phase reaction of trifluoroethene with photochemically-produced hydroxyl radicals has been estimated as 8.1X10-13 cu cm/molecule-sec at 25 °C(SRC) using a structure estimation method(1). This corresponds to an atmospheric half-life of about 20 days at an atmospheric concentration of 5X10+5 hydroxyl radicals per cu cm(1). The rate constant for the vapor-phase reaction of trifluoroethene with ozone has been estimated as 0.011X10-17 cu cm/molecule-sec at 25 °C(SRC) that was derived using a structure estimation method(1). This corresponds to an atmospheric half-life of about 100 days at an atmospheric concentration of 7X10+11 ozone molecules per cu cm(2). Trifluoroethene has an atmospheric lifetime of 250 years, with Global Warming Potentials of 8200, 9200, and 12,500 at 20, 100, and 500 years, respectively(3). Trifluoroethene is not expected to undergo hydrolysis in the environment due to the lack of functional groups that hydrolyze under environmental conditions(4). Trifluoroethene does not contain chromophores that absorb at wavelengths >290 nm(4), and therefore is not expected to be susceptible to direct photolysis by sunlight(SRC).
An estimated BCF of 3 was calculated in fish for trifluoroethene(SRC), using an estimated log Kow of 1.16(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is low(SRC).
Using a structure estimation method based on molecular connectivity indices(1), the Koc of trifluoroethene can be estimated to be 61(SRC). According to a classification scheme(2), this estimated Koc value suggests that trifluoroethene is expected to have high mobility in soil.
The Henry's Law constant for trifluoroethene is estimated as 0.43 atm-cu m/mole(SRC) using a fragment constant estimation method(1). This Henry's Law constant indicates that trifluoroethene is expected to volatilize rapidly from water surfaces(2). Based on this Henry's Law constant, the volatilization half-life from a model river (1 m deep, flowing 1 m/sec, wind velocity of 3 m/sec)(2) is estimated as 3 hours(SRC). The volatilization half-life from a model lake (1 m deep, flowing 0.05 m/sec, wind velocity of 0.5 m/sec)(2) is estimated as 4 days(SRC). Trifluoroethene's Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). Trifluoroethene is expected to volatilize from dry soil surfaces(SRC) based upon an estimated vapor pressure of 7.5X10+3 mm Hg(SRC), determined from a fragment constant method(3).
Occupational exposure to trifluoroethene may occur through inhalation and dermal contact with this compound at workplaces where trifluoroethene is produced or used. Atmospheric lifetime data indicate that the general population may be exposed to trifluoroethene via inhalation of ambient air. (SRC)
Trifluoroethylene Use and Manufacturing
Low toxicity by inhalation.
REFRIGERANTS, 39%; FOAM BLOWING AGENTS, 17%; SOLVENTS, 14%; FLUOROPOLYMERS, 14%; STERILANT GAS, 2%; AEROSOL PROPELLANTS, 2%; FOOD FREEZANT, 1%; OTHER, 8%; EXPORTS, 3% (1985) /FLUOROCARBONS/
Ethene, 1,1,2-trifluoro-: ACTIVE
GAS CHROMATOGRAPHIC METHOD FOR DETERMINING FLUOROCARBONS IN AIR IS DESCRIBED. CONCN IN AIR ARE DETERMINED DIRECTLY. /FLUOROCARBONS/|A GAS CHROMATOGRAPHIC PROCEDURE FOR DETERMINING ATMOSPHERIC LEVELS OF FLUOROCARBONS IS DESCRIBED. COLUMN IS TEMP PROGRAMMED TO SEPARATE HALOGENATED COMPONENTS WHILE MAINTAINING SHORT RETENTION TIMES FOR EACH COMPONENT. FREON 113 INCL. /FLUOROCARBONS/|GAS CHROMATOGRAPHIC METHOD FOR MEASURING HALOCARBONS IN AMBIENT AIR SAMPLES IS PRESENTED. /HALOCARBONS/
Computed Properties
Molecular Weight:82.02
XLogP3:1
Hydrogen Bond Acceptor Count:3
Exact Mass:82.00303452
Monoisotopic Mass:82.00303452
Heavy Atom Count:5
Complexity:42.9
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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