Trifluoromethane

HCID 6373CAS 75-46-7

Grundinformationen

Standard-SMILES
FC(F)F
InChIKey
XPDWGBQVDMORPB-UHFFFAOYSA-N
Summenformel
CHF3
Durchschnittliche Molmasse
70,014 g/mol
Monoisotopische Masse
70,00303469

Überblick

Trifluoromethane is a colorless nonflammable gas. It is shipped as a liquid under pressure. It may be narcotic in high concentrations. Under prolonged exposure to fire or heat the containers may rupture violently and rocket. It is used as a refrigerant.

Namen und Bezeichner

Bevorzugter Name
Trifluoromethane
IUPAC
fluoroform
Lokaler Name
Trifluormethan
Englischer Name
Trifluoromethane
Summenformel
CHF3
Molmasse
70.01

Namen und Synonyme

TRIFLUOROMETHANEFluoroform75-46-7Carbon trifluorideFreon 23Methane, trifluoro-Methyl trifluorideFluorylHalocarbon 23Arcton 1CHF3Refrigerant 23
Weitere Namen anzeigen
R-23Trifluoromethane(CHF3)TrifluormethanFluoroform ,98%Trifluoromethane (HFC-23)FE13
HFC-23Propellant 23Freon F-23R 23 (halocarbon)FC 23 (fluorocarbon)Genetron-23Freon R 23Genetron 23

Datenbank-Bezeichner

CAS
75-46-7
PubChem CID
6373
DTXSID
DTXSID0026410
ChEBI
CHEBI:41550
UNII
ZJ51L9A260
EC Number
200-872-4
Nikkaji
J2.392B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,5
Polarare Oberfläche (TPSA)
0 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
0
Schwere Atome
4

Experimentelle und physikochemische Eigenschaften

PFASPFAS -> PFAS with analytical method available
SolventsSolvents -> Chlorofluorocarbons
SpringerMaterials PropertiesDunham energy parameter
LogP · 2 Einträge

log Kow = 0.64

0.64

OdorOdorless
Density · 3 Einträge

0.673 g/cu cm at 25 °C (pressure > 1 atm)

Density: 1.935 (solid); critical density: 0.516. Chemically very inert. Stable up to 1150 °C

Relative density (water = 1): 1.44

Physikochemische Eigenschaften

Schmelzpunkt
160 °C · −160 °C(lit.)
Siedepunkt
84 °C · −84 °C(lit.)
Dichte
1.246 · 1.246
Dampfdichte
2.43 · 2.43 (vs air)
Dampfdruck
635 psi · 635 psi ( 21 °C)
Brechungsindex
1.215 · 1.2150

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 6 Einträge

Warning

H280 (100%): Contains gas under pressure; may explode if heated [Warning Gases under pressure]

P410+P403</a, and a href="https://pubchem.ncbi.nlm.nih.gov/ghs/#P410+P403">P410+P403 (click each P-code to see the statement)

Aggregated GHS information provided per 179 reports by companies from 5 notifications to the ECHA C&L Inventory.

Warning

H336: May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]

Gefahrenhinweise

Regulatory Information · 5 Einträge

Chemical: Methane, trifluoro-

Methane, trifluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Methane, trifluoro- 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)

Status: Active Update: 17-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/5767

Trifluoromethane: Non hazardous

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT Label · 2 Einträge

Non-Flammable Gas

Non-Flammable Gas

Fire Hazards · 5 Einträge

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

Excerpt from ERG Guide 120 [Gases - Inert (Including Refrigerated Liquids)]:

· Non-flammable gases.

· Some may burn but none ignite readily.

Not combustible. Gives off irritating or toxic fumes (or gases) in a fire.

Health Hazards · 4 Einträge

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

Excerpt from ERG Guide 120 [Gases - Inert (Including Refrigerated Liquids)]:

· Vapors may cause dizziness or asphyxiation without warning, especially when in closed or confined areas.

· Vapors may cause dizziness or asphyxiation without warning, especially when in closed or confined areas.

Hazards SummaryCauses narcosis at high concentrations; Cardiac sensitization is a potential complication of exposure; Deaths from sniffing abuse have been reported; [HSDB]
DOT ID and Guide · 2 Einträge

3136 120

1984 126

Sicherheit und Schutzausrüstung

Fire Fighting · 3 Einträge

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

Excerpt from ERG Guide 120 [Gases - Inert (Including Refrigerated Liquids)]:

In case of fire in the surroundings, use appropriate extinguishing media. In case of fire: keep cylinder cool by spraying with water.

First Aid Measures · 3 Einträge

Fresh air, rest. Artificial respiration may be needed. Refer for medical attention.

ON FROSTBITE: rinse with plenty of water, do NOT remove clothes. Refer for medical attention .

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Accidental Release Measures · 4 Einträge

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch or walk through spilled material.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch or walk through spilled material.

First Aid · 4 Einträge

Excerpt from ERG Guide 126 [Gases - Compressed or Liquefied (Including Refrigerant Gases)]:

Excerpt from ERG Guide 120 [Gases - Inert (Including Refrigerated Liquids)]:

General First Aid:

General First Aid:

Safe StorageCool. Ventilation along the floor.
Exposure Control and Personal Protection · 2 Einträge

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Toxikologische Informationen

Environmental Fate · 3 Einträge

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 32(SRC), determined from a structure estimation method(2), indicates that trifluoromethane is expected to have very high mobility in soil(SRC). Volatilization of trifluoromethane from moist soil surfaces is expected to be an important fate process(SRC) given a Henry's Law constant of 0.0952 atm-cu m/mole(3). Trifluoromethane is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 35,300 mm Hg at 25 °C(4). Biodegradation in soil is not expected based on aerobic pure culture studies(5).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 32(SRC), determined from a structure estimation method(2), indicates that trifluoromethane is not expected to adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is expected(3) based upon a Henry's Law constant of 0.0952 atm-cu m/mole(4). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 2.5 hours and 3.3 days, respectively(SRC). Estimated hydrolysis half-lives of 5.1 years and 190 days at pH values of 7 and 8, respectively(2), suggest that hydrolysis is not expected to be an important process(SRC). According to a classification scheme(5), an estimated BCF of 3(SRC), from its log Kow of 0.64(6) and a regression-derived equation(2), suggests the potential for bioconcentration in aquatic organisms is low(SRC). Biodegradation in water is not expected based on aerobic pure culture studies(7).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), trifluoromethane, which has a vapor pressure of 35,300 mm Hg at 25 °C(2), is expected to exist solely as a gas in the ambient atmosphere. Gas-phase trifluoromethane 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 140-160 years(SRC), calculated from rate constants of 2.7X10-16 to 2.8X10-16 cu cm/molecule-sec at 25 °C(3-5). Trifluoromethane does not contain chromophores that absorb at wavelengths >290 nm(6) and, therefore, is not expected to be susceptible to direct photolysis by sunlight(SRC). This relatively slow half-life in the lower atmosphere suggests that some trifluoromethane may gradually diffuse into the stratosphere(SRC). The diffusion half-life for transport from the troposphere to the stratosphere is on the order of 20 years(7). Trifluoromethane has Global Warming Potentials of 8200-15,486 (20 Yr), 9200-19,691 (100 Yr) and 9900-15,547 (500 Yr(4, 8-11). The atmospheric life-time for trifluoromethane has been calculated to be 234-295 years(4, 8-11).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Exposure RoutesThe substance can be absorbed into the body by inhalation.
Toxicity Summary · 1 Eintrag

IDENTIFICATION AND USE: Trifluoromethane (FC-23) is a colorless, odorless gas, or liquefied gas. It is used as refrigerant, intermediate in organic synthesis, direct coolant for infrared detector cells, blowing agent for urethane foams, and component in etch gas for integrated circuits material. HUMAN EXPOSURE AND TOXICITY: Five normal healthy male volunteers were exposed to concentrations of FC-23 between 10% and 60% (randomly interleaved with exposures to both room air and 40% nitrous oxide) in a within-subjects, double-blind design. Analyses of individual cases and ranked group data showed that individuals tolerated the 30% concentration of FC-23. ANIMAL STUDIES: In cats, inhaled at 60%, trifluoromethane had no effect on cerebral blood flow, the cerebral metabolic rate for oxygen, or oxyhemoglobin content. At 70%, trifluoromethane sensitized the cats' hearts to epinephrine, but to a much lesser degree than 40% chlorodifluoromethane, and produced only moderate changes in cerebral electrical activity as measured by the electroencephalogram. In other study, the acute cardiac and central nervous system effects of trifluoromethane were evaluated in eight anesthetized baboons. A dose-response effect was established for respiratory rate, electroencephalogram, and cardiac sinus rate, which exhibited a stepwise decrease from 10% trifluoromethane. No spontaneous arrhythmias were noted, and arterial blood pressure remained unchanged at any inspired level. Intravenous epinephrine infusions induced transient cardiac arrhythmia in 1 animal only at 70% (v/v) trifluoromethane. Trifluoromethane appears to induce mild dose-related physiological changes at inspired levels of 30% or more, indicative of an anesthetic effect. It significantly increased mutation rates in progeny of Drosophila over control levels.

Signs and Symptoms · 2 Einträge

Confusion. Drowsiness.

ON CONTACT WITH LIQUID: FROSTBITE.

Effluent Concentrations · 2 Einträge

Trifluoromethane has been detected in stack emissions effluent as a result of waste incineration(1). Trifluoromethane was detected in the effluent of feedstock/process emissions in The Netherlands in 1990 at a rate of 4797 kilo tons CO2 equivalents/year(2). Trifluoromethane emissions increased from 0.08 Gg/year to 15.4 Gg/year in China from 1980 to 2012(3).

Trifluoromethane is released into the atmosphere as a byproduct in the production of chlorodifluoromethane (a widely used chemical in refrigeration and air conditioning) and is used as a feedstock in pentafluoroethane production and fluoropolymer manufacture(1). Estimated release of trifluoromethane (Gg/year) in Asian countries is as follows(1):[Table#5269]

Sicherheitsdaten

wgk
1
tsca
TSCA listed
ridadr
UN 3136 2.2 (TRIFLUOROMETHANE, REFRIGERATED LIQUID)
hs_code
2903410000
RTECS-Nr.
PB6900000
hazard_code
F

Chemie und Industrie

Pharmakologische Informationen

Absorption, Distribution and Excretion... Main factor affecting fate of fluorocarbons is body fat, where they are concentrated & slowly released into blood @ concn that should not cause any risk of cardiac sensitization. /Fluorocarbons/

Verwendung und Herstellung

Uses · 5 Einträge

Used as a refrigerant, fire extinguishing agent, blowing agent for polyurethane foams, and intermediate in chemical production; [HSDB]

Refrigerant, intermediate in organic synthesis, direct coolant for infrared detector cells, blowing agent for urethane foams.

Refrigerant for low temperatures.

In refrigeration and air-conditioning systems ... CFC 13 /is replaced/ by HFC 23.

Component in etch gas for integrated circuits material

U.S. Production · 2 Einträge

2023: 550,000 - <700,000 lb

Non-confidential 2012 Chemical Data Reporting (CDR) information on the production and use of chemicals manufactured or imported into the United States. Chemical: Methane, trifluoro-. National Production Volume: Withheld.

Consumption PatternsRefrigerants, 39%; foam blowing agents, 14%; solvents, 14%; fluoropolymers, 14%; sterilant gas, 2%; aerosol propellants, 2%; food freezant, 1%; other, 8%; exports, 3% (1985) /fluorocarbons/
Industry UsesEtching agent
Methods of Manufacturing · 3 Einträge

In ethylene glycol solution at 180 °C, ... /sodium trifluoroacetate/ can be made to decompose quantitatively to trifluoromethane and carbon dioxide if a boric acid buffer is present.

Prepared from CHCl3 /chloroform/ and HF /hydrogen fluoride/.

Higher temperatures and higher hydrogen fluoride-to-substrate ratios are necessary to achieve complete replacement of all chlorine atoms in the starting chloro compounds by fluorine. Both liquid-phase halogen exchange in the presence of catalysts, such as antimony(V) or tin(IV) chlorofluorides and vapor phase reactions using solid-phase catalysts based on chromium are employed. Preferred starting materials are chloroform for HFC 23, dichloromethane for HFC 32, and 1,1,1-trichloroethane for HFC 143a. The conversion of tetrachloroethylene to HFC 125 and trichloroethylene to HFC 134a involves initial HF-addition across the double bond followed by a series of chlorine-fluorine exchange reactions.

Formulations/PreparationsGrade: 98% min purity.
Anwendungen · 3 Einträge

BeschreibungTrifluormethan bildet bei gewöhnlicher Temperatur ein farbloses, süßlich erstickend riechendes Gas. Es besitzt nur wissenschaftliches Interesse.

BeschreibungTrifluoromethane, CHF3, also known as fluoroform, propellant 23, and refrigerant 23, is a colorless gas that is nonflammable. There are no hazards listed for trifluoromethane. It may be an asphyxiant gas and displace oxygen in the air and in confined spaces. The fourdigit UN identification number is 2035 for the compressed gas and 3136 for the cryogenic liquid. The primary uses for trifluoromethane are as a refrigerant, as a direct coolant for infrared detector cells, and as a blowing agent for urethane foams.Strictly speaking, fluorocarbon compounds contain only the elements carbon, fluorine, and sometimes hydrogen. However, in industrial applications such as refrigerants and aerosol propellants, the term fluorocarbon has been used to include compounds containing chlorine and bromine atoms, or both. These industrial products have somewhat similar chemical and physical properties. Their relatively inert character and wide range of vapor pressures and boiling points make them especially well suited as refrigerants in a variety of applications, blowing agents for plastic foams, and aerosols.

VerwendenRefrigerant for low temperetures.

Darstellung · 1 Eintrag

synthetischeIodoform, and powdered CaF2 (as diluent) are ground together in a 20 : 33.4 : 40 ratio and placed in a 100ml glass flask, the outlet of which is joined to a liquid nitrogen-cooled trap, which in turn is connected to a drying tube containing P2O5.The flask is now heated by means of a sulfuric acid bath. The exothermic reaction starts at appr. 80°C and the temperature rises to appr. 180°C. Crude CHF3, colored by iodine, is collected in the trap.After completion of the reaction, the product is fractionated. The cut coming over at a bath temperature between -40 and -30°C is practically pure CHF3. It is washed with 2N NaOH and dried over P2O5;. The yield is 45%.

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