Grundinformationen
- Standard-SMILES
FC(F)(Br)C(F)(F)Br- InChIKey
KVBKAPANDHPRDG-UHFFFAOYSA-N- Summenformel
- C2Br2F4
- Durchschnittliche Molmasse
- 259,82 g/mol
- Monoisotopische Masse
- 257,83028708
Überblick
proposed fire extinguishing agent; causes hepatotoxicity; structure
Namen und Bezeichner
- Bevorzugter Name
- 1,2-Dibromo-1,1,2,2-tetrafluoroethane
- IUPAC
- 1,2-dibromo-1,1,2,2-tetrafluoroethane
- Lokaler Name
- 1,2-Dibromtetrafluorethan
- Englischer Name
- 1,2-Dibromotetrafluoroethane
- Summenformel
- C2Br2F4
- Molmasse
- 259.82
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
124-73-2- PubChem CID
- 31301
- DTXSID
DTXSID0041226- UNII
- 1NJ2ZF1UN5
- EC Number
- 204-711-9
- Nikkaji
- J383B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,3
- Polarare Oberfläche (TPSA)
- 0 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 8
- Formalladung
- 0
- Komplexität
- 78
Experimentelle und physikochemische Eigenschaften
Density
2.149 g/cu cm at 25 °C
Critical volume: 341.1 cu cm/mol; critical density: 0.7616 g/cu cm; specific heat: 43.1 cal/K-mol at 25 °C
Decomposition
Under certain conditions, fluorocarbon vapors may decompose on contact with flames or hot surfaces, creating the potential hazard of inhalation of toxic decomposition products. /Fluorocarbons/
When heated to decomposition it emits toxic fumes of /hydrogen bromide and hydrogen fluoride/.
The pyrolysis products of Halon 2402 during fire are toxic to animals. In a chamber of 20 cu m, a small hexane fire was extinguished with direct spray of the agent. The higher the rate of discharge of this propellant, the lower the amount of the decomposition products formed. The mortality of rats and guinea pigs due to the inhalation of carbon monoxide was high especially when the extinguisher was discharged slowly.
Vapor Pressure
325.0 [mmHg]
3.25X10+2 mm Hg at 25 °C (ext)
Physikochemische Eigenschaften
- Schmelzpunkt
- -110 · -110,5°C
- Siedepunkt
- 47 · 47,3°C
- Dichte
- 2 · 2,175 g/cm3
- Brechungsindex
- 1.347 · 1.347
- storage temp.
- 2 · Storage temp. 2-8°C
- Henry's Law Constant
- 2.7 · 2.7×10-7 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
- Stabilität
- Stable.
- InChI
- InChI=1S/C2Br2F4/c3-1(5,6)2(4,7)8
- InChIKey
- KVBKAPANDHPRDG-UHFFFAOYSA-N
- SMILES
- C(F)(F)(Br)C(F)(F)Br
- CAS Datenbank
- 124 · 124-73-2(CAS DataBase Reference)
- NIST chemische Informationen
- 1 · Ethane, 1,2-dibromo-1,1,2,2-tetrafluoro-(124-73-2)
- EPA chemische Informationen
- 1 · 1,2-Dibromo-1,1,2,2-tetrafluoroethane (124-73-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H420 (100%): Harms public health and the environment by destroying ozone in the upper atmosphere [Warning Hazardous to the ozone layer]
P502</a, and a href="https://pubchem.ncbi.nlm.nih.gov/ghs/#P502">P502 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Not Classified
Gefahrenhinweise
Regulatory Information
Chemical: Ethane, 1,2-dibromo-1,1,2,2-tetrafluoro-
Ethane, 1,2-dibromo-1,1,2,2-tetrafluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Ethane, 1,2-dibromo-1,1,2,2-tetrafluoro- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Special Reports
Zakhari S, Aviado DM; Cardiovascular Toxicology of Aerosol Propellants, Refrigerants and Related Solvents; Target Organ Toxicology Series: Cardiovascular Toxicology, XII+ 388 pages; Raven Press: New York, NY 281-326 (1982). Review of the toxicology of aerosol propellants, refrigerants and related solvents on the cardiovascular system of humans.
Measurements of UV photoabsorption cross sections in the wavelength region 174-270 nm are reported for 12 halocarbons, eg Freon 11, choroform, and trichloroethylene. The importance of various halocarbons as sources of free halogen atoms in the stratosphere is discussed.[NASA; UV Photoabsorption Cross Sections for Halocarbons. Intl Conf Probl Relat Stratos 1976, NASA Doc No. NASA-CR-154106, p.255-7 (1977)]
Toxic Combustion Products
All fluorocarbons will undergo thermal decomposition when exposed to flame or red-hot metal. Decomposition products of the chlorofluorocarbons will include hydrofluoric and hydrochloric acid along with smaller amounts of phosgene and carbonyl fluoride. The last compound is very unstable to hydrolysis and quickly changes to hydrofluoric acid and carbon dioxide in the presence of moisture. /Fluorocarbons/
In contact with open flame or very hot surface fluorocarbons may decompose into highly irritant and toxic gases: chlorine, hydrogen fluoride or chloride, and even phosgene. /Fluorocarbon refrigerant and propellants/
Under certain conditions, fluorocarbon vapors may decompose on contact with flames or hot surfaces, creating the potential hazard of inhalation of toxic decomposition products. /Fluorocarbons/
Sicherheit und Schutzausrüstung
Fire Fighting Procedures
If material involved in fire: Extinguish fire using agent suitable for type of surrounding fire. (Material itself does not burn or burns with difficulty). Cool all affected containers with flooding quantities of water. Apply water from as far a distance as possible. /Refrigerants NEC, gas or liquid, nonflammable (refrigerant, gas, NOS or dispersant gas, NOS/
Preventive Measures
Sufficient exhaust and general ventilation should be provided to keep vapor concentration below recommended levels. /Fluorocarbons/
Inhalation of fluorocarbon vapors should be avoided. /Fluorocarbons/
Forced air ventilation at the level of vapor concentration together with the use of individual breathing devices with independent air supply will minimize the risk of inhalation. Lifelines should be worn when entering tanks or other confined spaces. /Fluorocarbons/
Enclosure of process materials and isolation of reaction vessels and proper design and operation of filling heads for packaging and shipping /are administrative controls that may be instituted to limit occupational exposure to fluorocarbons during manufacture, packaging, and use/. /Fluorocarbons/
For more Preventive Measures (Complete) data for 1,2-DIBROMOTETRAFLUOROETHANE (7 total), please visit the HSDB record page.
Personal Protective Equipment (PPE)
Many of the fluorocarbons are good solvents of skin oil, so protective ointment should be used. /Fluorocarbons/
Neoprene gloves, protective clothing, and eye protection minimize risk of topical contact. Degreasing effect on skin can be treated with lanolin ointment. /Fluorocarbons/
Forced air ventilation at level of vapor concentration together with use of individual breathing devices with independent air supply will minimize risk of inhalation. Lifelines should be worn when entering tanks or other confined spaces. /Fluorocarbons/
Toxikologische Informationen
Interactions
If inhalation occurs, epinephrine or other sympathomimetic amines and adrenergic activators should not be admin since they will further sensitize heart to development of arrhythmias. /fluorocarbons/
Inhalation by mice of dibromotetrafluoroethane (0.63-1.0%) for 5 hr daily for 3 or 4 days reduced hexobarbital (120 mg/kg) sleeping time and zoxazolamine (100 mg/kg) paralysis time 2 fold. Hepatic microsomal hexobarbital oxidase and zoxazolamide hydroxylase activities were increased but DFK 525-A in the assay inhibited the increase in hepatic microsomal hexobarbital oxidase.
The combination of cyanide, hydrobromic acid and freon-114B2 in air due to pyrolytic degradation of freon used in fire extinguishers may have a toxic effect on humans exposed to fumes. The combination of freon-114B2 (inhaled) and cyanide, administered ip as sodium cyanide, had an additive toxic effect on mice. Freon-114B2, a narcotic, inhibited tissue respiration at the flavoprotein and cytochrome stage; the cyanide affected the oxidoreductase and, in part, the cytochrome/oxidase systems. A combination of sodium cyanide and hydrobromic acid administered ip to rats had an antagonistic effect. Hydrobromic acid, a nonspecific irritant, acted as a stress factor and induced body resistance to the combined effect. LD84 (LD for 84% of subjects), LD50 and LD16 (LD for 16% of subjects) values for sodium cyanide and hydrobromic acid were also determined.
Environmental Fate
TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 220(SRC), determined from a structure estimation method(2), indicates that 1,2-dibromotetrafluoroethane is expected to have moderate mobility in soil(SRC). Volatilization of 1,2-dibromotetrafluoroethane from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 37 atm-cu m/mole(SRC), calculated from a vapor pressure of 325 mm Hg at 25 °C(3) and a water solubility of 3.00 mg/L at 25 °C(4). 1,2-Dibromotetrafluoroethane is expected to volatilize from dry soil surfaces(SRC) based upon its vapor pressure(3). Biodegradation data for 1,2-dibromotetrafluoroethane were not available, but since it is fully halogenated, biodegradation is not expected to be an important fate process(SRC, 2005).
AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 220, determined from a structure estimation method(2), indicates that 1,2-dibromotetrafluoroethane 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 37 atm-cu m/mole(SRC), calculated from a vapor pressure of 325 mm Hg(4) and the water solubility(5). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 1.6 hours and 6.4 days, respectively(SRC). According to a classification scheme(6), an estimated BCF of 340(SRC), from its water solubility(5) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is high(SRC). Biodegradation data for 1,2-dibromotetrafluoroethane were not available, but since it is fully halogenated, biodegradation is not expected to be an important fate process(SRC, 2005).
ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), 1,2-dibromotetrafluoroethane, which has a vapor pressure of 325 mm Hg at 25 °C(2), is expected to exist solely as a vapor in the ambient atmosphere. Vapor-phase 1,2-dibromotetrafluoroethane is not expected to be degraded in the atmosphere by reaction with photochemically-produced hydroxyl radicals(SRC) based on an estimated half-life of over 300 years for this reaction in air(SRC), calculated from its rate constant of 1.30X10-16 cu cm/molecule-sec at 25 °C(3). 1,2-Dibromotetrafluoroethane does not contain chromophores that absorb at wavelengths >290 nm and therefore is not expected to be susceptible to direct photolysis by sunlight in the troposphere(SRC). However, as this substance rises into the stratosphere, it is expected to be broken down by shorter wavelength UV radiation(4). As a result, bromide radicals will be released into the stratosphere where they can contribute to the destruction of atmospheric ozone(4-6).
Soil Adsorption/Mobility
Using a structure estimation method based on molecular connectivity indices(1), the Koc of 1,2-dibromotetrafluoroethane can be estimated to be 220(SRC). According to a classification scheme(2), this estimated Koc value suggests that 1,2-dibromotetrafluoroethane is expected to have moderate mobility in soil.
Human Toxicity Excerpts
/SIGNS AND SYMPTOMS/ Excessive skin contact with liquid fluorocarbons should be minimized to prevent defatting of skin ... /Fluorocarbons/
/SIGNS AND SYMPTOMS/ Early ... human experience indicated that high vapor concn (eg, 20%) may cause confusion, pulmonary irritation, tremors and rarely coma, but that these effects were generally transient and without late sequelae. ... Cause of death /from abuse of fluorocarbons/ is in considerable doubt. Freezing of airway soft tissues can probably be eliminated as a cause of death except in cases where the product was sprayed directly into the mouth from its container or from a balloon containing some liquid. Laryngeal spasm or edema, oxygen displacement, or sensitization of myocardium to endogenous catecholamines with subsequent ventricular fibrillation appear to be reasonable possibilities. /fluorocarbon refrigerants and propellants/
/EPIDEMIOLOGY STUDIES/ In a cross-sectional study the neurological effects of fluorocarbons were evaluated in 27 refrigeration repair workers. Fourteen age matched reference subjects were selected from a local union of plumbers, pipe-fitters, and insulation workers. A case of peripheral neuropathy in a commercial refrigeration repairman prompted the investigation. Personal air samples from 2 worker-participants over the course of a typical workshift showed 1.4 ppm chlorodifluoromethane and 2.2 ppm chloropenta-fluoroethane. There were no cases of peripheral neuropathy in the study subjects. There was no significant difference in mean nerve conduction velocities (ulnar, median, peroneal, sural, tibial) between study and reference subjects. Lightheadedness and palpitations were reported significantly more often by refrigeration repair workers (p<0.05). /Fluorocarbons/
/CASE REPORTS/ There are isolated reports of poisoning from exposure to fluorocarbon propellants and some studies showing a higher incidence of coronary heart disease among hospital personnel and refrigerant mechanics exposed to fluorocarbons. /Fluorocarbons/
For more Human Toxicity Excerpts (Complete) data for 1,2-DIBROMOTETRAFLUOROETHANE (7 total), please visit the HSDB record page.
Artificial Pollution Sources
1,2-Dibromotetrafluoroethane's production and use as a refrigerant and control fluid(1) may result in its release to the environment through various waste streams(SRC). Its use as a fire-extinguishing agent(1) may result in its direct release to the environment(SRC). However, in accordance with the the Montreal Protocol of 1987, production and consumption of this substance was to be phased out in developed nations in 1994, and is scheduled to be phased out in non-developed nations by 2010(2,3).
Environmental Bioconcentration
An estimated BCF of 340 was calculated for 1,2-dibromotetrafluoroethane(SRC), using a water solubility of 3.00 mg/L(1) and a regression-derived equation(2). According to a classification scheme(3), this BCF suggests the potential for bioconcentration in aquatic organisms is high(SRC), provided the compound is not metabolized by the organism(SRC).
Volatilization from Water/Soil
The Henry's Law constant for 1,2-dibromotetrafluoroethane is estimated as 37 atm-cu m/mole(SRC) derived from its vapor pressure, 325 mm Hg(1), and water solubility, 3.00 mg/L(2). This Henry's Law constant indicates that 1,2-dibromotetrafluoroethane is expected to volatilize rapidly from water surfaces(3). 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)(3) is estimated as 1.5 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)(3) is estimated as 6.4 days(SRC). 1,2-Dibromotetrafluoroethane's estimated Henry's Law constant indicates that volatilization from moist soil surfaces may occur(SRC). The potential for volatilization of 1,2-dibromotetrafluoroethane from dry soil surfaces may exist based upon the vapor pressure(1).
Non-Human Toxicity Excerpts
/LABORATORY ANIMALS: Acute Exposure/ Early animal ... work indicated that high vapor concentration (e.g., 20%) may cause confusion, pulmonary irritation, tremors and rarely coma, but that these effects were generally transient and without late sequelae. /fluorocarbon refrigerants and propellants/
/LABORATORY ANIMALS: Acute Exposure/ Exposure of mice to atmosphere containing 0.25-5% Halon 2402 for 5 hr/day for 3 days significantly incr hexobarbital sleeping time and zoxazolamine paralysis time at concn of >1.0%. Halon 2402 increased hexobarbital oxidase and zoxazolamine hydroxylase activity at concn of 1%. Pharmacological effects of Halon 2402 exposure were convulsions at 2-3%, /SRP: CNS depression/ at 4-5%, and death at 5-6%.
/LABORATORY ANIMALS: Acute Exposure/ The effects of serum aspartate aminotransferase, liver triglycerides, and double-bond shifting in liver microsomal lipids after administration of halo alkanes, eg carbon tetrachloride, orally, ip, or by inhalation were observed with or without preliminary administration or phenobarbital (5, 5, and 8 mg/100 g, ip, at 0, 6, and 24 hr, respectively, 2 days before poisoning or 2-propanol (4.2 mmoles/100 g orally, 18 hr before poisoning). The lethality of the halo alkanes and their interaction with barbiturates depended on the dose and method of administration.
/LABORATORY ANIMALS: Subchronic or Prechronic Exposure/ Exposure of rats to Freon-114B2 at 2009.4 mg/cu m for 2 mo decr the activity of cerebral lactate dehydrogenase isozyme1 and incr the activity of lactate dehydrogenase isozyme5. Similar. but less significant changes occured in brain of rats chronically exposed to 1085.2 mg Freon-114B2/cu m + 1.1 mg hydrogen fluoride/cu m. The observed changes in isozyme ratio may indicate disruption of carbohydrate metabolism during prolonged Freon action.
For more Non-Human Toxicity Excerpts (Complete) data for 1,2-DIBROMOTETRAFLUOROETHANE (6 total), please visit the HSDB record page.
Populations at Special Risk
In persons with impaired pulmonary function, especially those with obstructive airway diseases, the breathing of Refrigerant 114 might cause exacerbation of symptoms due to its irritant properties. ... In persons with impaired cardiovascular function, especially those with history of cardiac arrhythmias, the inhalation of Refrigerant 114 might cause exacerbation of disorders of the conduction mechanism due to sensitizing effects on the myocardium. /Freon 114/
It is possible that pt with cardiac or resp disorders may prove esp susceptible. /fluorocarbons/
Environmental Abiotic Degradation
The rate constant for the vapor-phase reaction of 1,2-dibromotetrafluoroethane with photochemically-produced hydroxyl radicals is 1.30X10-16 cu cm/molecule-sec at 25 °C(1). This corresponds to an atmospheric half-life of greater than 300 years at an atmospheric concentration of 5X10+5 hydroxyl radicals per cu cm(2). 1,2-Dibromotetrafluoroethane does not contain chromophores that absorb at wavelengths >290 nm and therefore is not expected to be susceptible to direct photolysis by sunlight in the troposphere(SRC). However, as this substance rises into the stratosphere, it is expected to be broken down by shorter wavelength UV radiation(3). As a result, bromide radicals will be released into the stratosphere where they can contribute to the destruction of atmospheric ozone(3-5). 1,2-Dibromotetrafluoroethane is not expected to undergo hydrolysis in the environment due to the lack of functional groups that hydrolyze under environmental conditions(6).
Probable Routes of Human Exposure
NIOSH (NOES Survey 1981-1983) has statistically estimated that 54,597 workers are potentially exposed to 1,2-dibromotetrafluoroethane in the USA(1). Occupational exposure to 1,2-dibromotetrafluoroethane may occur through inhalation and dermal contact with this compound at workplaces where 1,2-dibromotetrafluoroethane is produced or used. However, occupational exposure is not expected in developed nations such as the United States where production and consumption of this chemical has been phased out in accordance with the Montreal Protocol(SRC).
... IN THE MANUFACTURE, USE, SERVICING, & DISPOSAL OF REFRIGERATION UNITS, FOOD PROCESSING, SOLVENT APPLICATIONS, PLASTIC FOAM BLOWING, & FIRE EXTINGUISHING. /FLUOROCARBONS/
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 3082
- risk_code
- 36/37/38-59-36/38
- Toxizität
- mouse,LC50,inhalation,300gm/m3/2H (300000mg/m3),BEHAVIORAL: ATAXIABEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)LUNGS, THORAX, OR RESPIRATION: CYANOSIS,Trudy Leningradskogo Sanitarno-Gigienicheskogo Meditsinskogo Instituta. Vol. 75, Pg. 241, 1963.
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36-61
- hazard_class
- 6.1(b)
- packing_group
- III
- Giftige Stoffe Daten
- 124-73-2(Hazardous Substances Data)
Chemie und Industrie
Pharmakologische Informationen
Absorption, Distribution and Excretion
... Main factor affecting fate of fluorocarbons is body fat, where they are concentrated and slowly released into blood at concentrations that should not cause any risk of cardiac sensitization. /fluorocarbons/
There is a significant accumulation of fluorocarbons in brain, liver and lung compared to blood levels, signifying a tissue distribution of fluorocarbons similar to that of chloroform. /fluorocarbons/
Abosrption of fluorocarbons is much lower after oral ingestion (35-48 times) than after inhalation. ... The lung generally has the highest fluorocarbon concentrations on autopsy. /Fluorocarbons/
Although fluorocarbons cause cardiac sensitization in certain animal species, rapid elimination prevents the development of cardiotoxic concentrations from aerosol bronchodilator use except at exceedingly high doses (12 to 24 doses in 2 minutes). /Fluorocarbons/
Fluorocarbon compounds are lipid-soluble and thus are generally well absorbed through lung. Absorption after ingestion is 35 to 48 times lower than after inhalation. ... Fluorocarbons are eliminated by way of lung. /fluorocarbon compounds/
Verwendung und Herstellung
Uses
Used as a refrigerant, fire-extinguishing agent, and control fluid; [HSDB]
Refrigerant, fire-extinguishing agent, control fluid
Its use as a fire-extinguishing agent(1) may result in its direct release to the environment(SRC). However, in accordance with the the Montreal Protocol of 1987, production and consumption of this substance was to be phased out in developed nations in 1994, and is scheduled to be phased out in non-developed nations by 2010(2,3).
Fire extinguisher
Production and consumption of 1,2-dibromotetrafluoroethane in developed nations was scheduled to have been phased out by 1994 in accordance with the Montreal Protocol of 1987 since 1,2-dibromotetrafluoroethane is listed as an ozone depleting chemical.
U.S. Production
2023: <50,000 lb
(2000) 10 thousand - 500 thousand pounds
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Ethane, 1,2-dibromo-1,1,2,2-tetrafluoro-: ACTIVE
Bromofluoromethanes are obtained by bromination of a stream of the appropriate fluoromethane or chlorofluoromethane at 300 to 600 °C. Ethane derivatives can also be obtained by thermal bromination or by addition of bromine or hydrogen bromide to fluoroolefins. In some cases hydrogen bromide can be used to exchange a chlorine atom in a chlorofluoroalkane for a bromine atom. /Bromofluoroalkanes/
The bromine-containing fluorocarbons operate by chemical interruption of the combustion chain, and are used in total flooding systems for computer rooms and telephone facilities, as well as aircraft and portable fire extinguishers, including use on the air force p-13 rapid intervention crash trucks. Halon emerges from the fire extinguisher nozzle as a mixture of 85 percent liquid and 15 percent vapor and is discharged over long distances. It completely vaporizes upon contact with fire. /brominated fluorocarbons/
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