Difluoromethane

HCID 6345CAS 2154-59-8

基本情報

標準SMILES
FCF
InChIKey
RWRIWBAIICGTTQ-UHFFFAOYSA-N
分子式
CH2F2
平均分子量
52.023 g/mol
単同位体質量
52.0124565

概要

Difluoromethane appears as a colorless odorless gas. Insoluble in water and has a high thermal stability. Its vapors are heavier than air. Under prolonged exposure to fire or intense heat the containers may rupture violently and rocket. Contact with the unconfined liquid can cause frostbite. Used as a refrigerant.

名称と識別子

優先名称
Difluoromethane
IUPAC
difluoromethane
英語名
Difluoromethane
分子式
CH2F2
分子量
52.0233864

名称と別名

DIFLUOROMETHANE75-10-5Methylene difluorideMethane, difluoro-Freon 32Genetron 32Carbon fluoride hydrideHFC-32R 32 (refrigerant)Freon-32HFC 32Khladon 32
名称をさらに表示
GENETRON-3277JW9K722XECOLO ACE-32DTXSID6029597CHEBI:47855RefChem:133596DTXCID409597200-839-4

データベース識別子

CAS
2154-59-8、75-10-5
PubChem CID
6345
DTXSID
DTXSID6029597
ChEMBL
CHEMBL115186
ChEBI
CHEBI:47855
UNII
77JW9K722X
EC Number
200-839-4
Nikkaji
J28.328B

物性

構造計算による物性

XLogP
1
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
0
重原子数
3

実験および物理化学的性質

PFASPFAS -> PFAS with analytical method available
SolventsSolvents -> Chlorofluorocarbons
SpringerMaterials Properties19F nuclear magnetic resonance spectrum
LogPlog Kow = 0.20
Density · 3 件

0.961 at 25 °C; 1.052 at 0 °C (liquid)

Density: 1.2139 g/cu cm at -52 °C

Critical density: 0.430

Color/Form · 2 件

Colorless gas

Colorless gas at ambient conditions

物理化学的性質

融点
-136 °C · -136 °C
沸点
-51.6 °C · -51.6 °C
比重(密度)
0.5265 g/cm3 · 0.5265 g/cm3

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H220 (78.2%): Extremely flammable gas [Danger Flammable gases]

P203, P210, P222, P280, P318, P377, P381, P403, P405, P410+P403, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 294 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H220: Extremely flammable gas [Danger Flammable gases]

危険有害性情報

Regulatory Information · 4 件

Chemical: Methane, difluoro-

Methane, difluoro- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Methane, difluoro- 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: 23-03-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/15279

Methane, difluoro-: HSNO Approval: HSR001023 Approved with controls

DOT LabelFlammable Gas
Fire Hazards · 2 件

Excerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

· EXTREMELY FLAMMABLE.

Fire PotentialDifluoromethane is a flammable gas.
Health Hazards · 2 件

Excerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

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

Hazards Summary · 1 件

Evaporating liquid can cause frostbite; May cause asphyxiation without warning; [CAMEO] Evaporating liquid can cause frostbite; Inhalation of high concentrations can cause CNS depression and cardiac arrhythmias; In confined space spill, may displace air and act as simple asphyxiant; [MSDSonline]

安全と保護具

Fire FightingExcerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:
Accidental Release Measures · 2 件

· 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.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 件

Excerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Fire Fighting Procedures · 1 件

If material on fire or involved in fire: Do not extinguish fire unless flow can be stopped. Use water in flooding quantities as fog. Cool all affected containers with flooding quantities of water. Apply water from as far a distance as possible. ... If fire becomes uncontrollable or container is exposed to direct flame-- consider evacuation of one-half (1/2) mile radius.

Nonfire Spill ResponseExcerpt from ERG Guide 115 [Gases - Flammable (Including Refrigerated Liquids)]:

毒性情報

Environmental Fate · 3 件

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 22(SRC), determined from a structure estimation method(2), indicates that difluoromethane is expected to have very high mobility in soil(SRC). Volatilization of difluoromethane from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 0.29 atm-cu m/mole(SRC), using a fragment constant estimation method(2). Difluoromethane is expected to volatilize from dry soil surfaces(SRC) based upon a vapor pressure of 12,600 mm Hg at 25 °C(3). Difluoromethane, present at 3.38 mg/L, reached 8% of its Theoretical oxygen demand in 28 days using an activated sludge inoculum in the OECD 301D test(4), indicating that biodegradation is not an important environmental fate process(SRC).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 22(SRC), determined from a structure estimation method(2), indicates that difluoromethane 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 0.29 atm-cu m/mole(SRC), developed using a fragment constant estimation method(2). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 2 hours and 3 days, respectively(SRC). Difluoromethane is not expected to undergo hydrolysis in the environment due to the lack of functional groups that hydrolyze under environmental conditions(3). According to a classification scheme(4), an estimated BCF of 3(SRC), from its log Kow of 0.20(5) and a regression-derived equation(2), suggests the potential for bioconcentration in aquatic organisms is low(SRC). Difluoromethane, present at 3.38 mg/L, reached 8% of its Theoretical oxygen demand in 28 days using an activated sludge inoculum in the OECD 301D screening test(6).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), difluoromethane, which has a vapor pressure of 12,600 mm Hg at 25 °C(2), is expected to exist solely as a gas in the ambient atmosphere. Gas-phase difluoromethane 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 4 years(SRC), calculated from the preferred rate constant value of 1.1X10-14 cu cm/molecule-sec(3). The reaction of difluoromethane with hydroxyl radicals will form carbonyl difluoride(4). Atmospheric life-times for difluoromethane have been reported as 5.28-7.3 years(4-8). Difluoromethane has estimated 20-, 100- and 500-year Global Warming Potentials of 1800-2920, 550-889 and 180-276, respectively(4-7). Difluoromethane does not contain chromophores that absorb at wavelengths >290 nm(9) and, therefore, is not expected to be susceptible to direct photolysis by sunlight(SRC).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Toxicity Summary · 1 件

IDENTIFICATION AND USE: Difluoromethane (HFC32) is a colorless gas. It is used in refrigeration, organic synthesis, and as a tracer gas in gas chromatography and photoacoustic spectroscopy. HUMAN EXPOSURE AND TOXICITY: There are no data available. ANIMAL STUDIES: Inhalation of HFC32 (up to 50,000 ppm) caused no organ-specific effects. HFC32 did not sensitize the heart to adrenaline. HFC32 is slightly maternally and developmentally toxic at 50,000 ppm in rats, but not in rabbits. No evidence of teratogenicity was noted in rats or rabbits.

Effluent ConcentrationsDifluoromethane was detected in stack emissions from waste incineration(1). Difluoromethane emissions increased over the period of 2005 to 2013 from 0.1 to 12 Gg/year in China(2).
Soil Adsorption/Mobility · 1 件

Using a structure estimation method based on molecular connectivity indices(1), the Koc of difluoromethane can be estimated to be 22(SRC). According to a classification scheme(2), this estimated Koc value suggests that difluoromethane is expected to have very high mobility in soil.

Artificial Pollution SourcesDifluoromethane's production and use as a refrigerant(1), coolant(1) and a tracer gas(2) may result in its release to the environment through various waste streams(SRC).

化学と産業

薬理情報

Metabolism/Metabolites · 2 件

Difluoromethane (HFC32) is under development as a replacement for chlorofluorocarbons (CFCs) in some refrigeration applications. It has been evaluated by standard studies of toxicity, developmental toxicity, and genotoxicity. In addition, the metabolism and disposition of HFC32 was investigated and a physiologically based pharmacokinetic (PB-PK) model constructed /using rats and rabbits/. ... The pharmacokinetics of [(14)C]difluoromethane (10,000 to 50,000 ppm/6 hr) revealed that about 2.1% of the inhaled HFC32 was absorbed and that steady state blood levels were achieved within 2 hr and were proportional to dose. Carbon dioxide was the major metabolite of HFC32 at all exposure levels. Carbon monoxide was not detected. The in vivo data were used to validate a PB-PK model to describe the uptake and metabolism of HFC32. Absorption and distribution are adequately described using rat blood:air and tissue:air partition coefficients. Metabolism, which was linear across the dose range, was described by a first order rate constant (Kf = 8.98 hr-1). Of the absorbed HFC32, about 63% was metabolized at all doses; however, when metabolism was expressed as a percentage of the inhaled dose it was much lower, being about 1.4% of the HFC32 entering the airways. ... /rat, rabbit/

Difluoromethane (HFC32) is under development as a replacement for chlorofluorocarbons (CFCs) in some refrigeration applications. The metabolism and disposition of [(14)C]-difluoromethane ([(14)C]-HFC32) was determined in male Swiss mice as a consequence of a single 6 hr inhalation exposure to atmospheres of 10 000 ppm. Of the inhaled dose, about 1-2% was recovered in expired air, urine, feces and carcass suggesting that systemic absorption of this hydrofluorocarbon from the alveolar air space of the lung into blood is poor. Upon cessation of exposure the majority of the systemically absorbed HFC32 was exhaled within 1 hr. Carbon dioxide was a major metabolite of HFC32. Carbon dioxide measured post-exposure accounted for about 0.3% of the inhaled dose. Urinary and fecal excretion of non-volatile metabolites accounted for about 0.34% and 0.07% of the inhaled dose, respectively. Carbon monoxide could not be detected. Total metabolism, measured as the sum of the radioactivity recovered in urine, feces, as carbon dioxide and that retained in the carcass, amounted to about 0.8% of the inhaled dose, equivalent to 64% of the total radioactivity recovered. Analysis of a range of tissues at 4 days post-exposure showed a relatively uniform distribution of radioactivity with the highest concentration in the lung, liver and kidney. There was no evidence of a specific retention in any organ or tissue.

Absorption, Distribution and Excretion · 2 件

Difluoromethane (HFC32) is under development as a replacement for chlorofluorocarbons (CFCs) in some refrigeration applications. It has been evaluated by standard studies of toxicity, developmental toxicity, and genotoxicity. In addition, the metabolism and disposition of HFC32 was investigated and a physiologically based pharmacokinetic (PB-PK) model constructed /using rats and rabbits/. ... The pharmacokinetics of [(14)C]difluoromethane (10,000 to 50,000 ppm/6 hr) revealed that about 2.1% of the inhaled HFC32 was absorbed and that steady state blood levels were achieved within 2 hr and were proportional to dose. Carbon dioxide was the major metabolite of HFC32 at all exposure levels. Carbon monoxide was not detected. The in vivo data were used to validate a PB-PK model to describe the uptake and metabolism of HFC32. Absorption and distribution are adequately described using rat blood:air and tissue:air partition coefficients. Metabolism, which was linear across the dose range, was described by a first order rate constant (Kf = 8.98 hr-1). Of the absorbed HFC32, about 63% was metabolized at all doses; however, when metabolism was expressed as a percentage of the inhaled dose it was much lower, being about 1.4% of the HFC32 entering the airways. ...

Difluoromethane (HFC32) is under development as a replacement for chlorofluorocarbons (CFCs) in some refrigeration applications. The metabolism and disposition of [(14)C]-difluoromethane ([(14)C]-HFC32) was determined in male Swiss mice as a consequence of a single 6 hr inhalation exposure to atmospheres of 10,000 ppm. Of the inhaled dose, about 1-2% was recovered in expired air, urine, feces and carcass suggesting that systemic absorption of this hydrofluorocarbon from the alveolar air space of the lung into blood is poor. Upon cessation of exposure the majority of the systemically absorbed HFC32 was exhaled within 1 hr. Carbon dioxide was a major metabolite of HFC32. Carbon dioxide measured post-exposure accounted for about 0.3% of the inhaled dose. Urinary and fecal excretion of non-volatile metabolites accounted for about 0.34% and 0.07% of the inhaled dose, respectively. Carbon monoxide could not be detected. Total metabolism, measured as the sum of the radioactivity recovered in urine, feces, as carbon dioxide and that retained in the carcass, amounted to about 0.8% of the inhaled dose, equivalent to 64% of the total radioactivity recovered. Analysis of a range of tissues at 4 days post-exposure showed a relatively uniform distribution of radioactivity with the highest concentration in the lung, liver and kidney. There was no evidence of a specific retention in any organ or tissue.

用途と製造

Uses · 4 件

Used as a refrigerant and to make other chemicals; [Hawley]

Field-scale tests were performed to evaluate the effectiveness of the gas-phase partitioning tracer method for in-situ measurement of soil-water content. The tracer tests were conducted before and after a controlled infiltration event to evaluate performance at two water contents. Nonpartitioning (sulfur hexafluoride) and water-partitioning (difluoromethane) tracers were injected into the test zone, and their effluent breakthrough curves were analyzed using the method of moments to calculate retardation factors for difluoromethane. ...

/As a tracer gas in gas chromatography and photoacoustic spectroscopy./

Refrigeration, organic synthesis.

U.S. Production · 2 件

2023: 70,000,000 - <85,000,000 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, difluoro-. National Production Volume: 31,508,168 lb/yr.

Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesRefrigerants
Methods of Manufacturing · 1 件

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.

General Manufacturing Information · 3 件

Wholesale and Retail Trade

Methane, difluoro-: ACTIVE

Hydrofluorocarbon refrigerant with zero ozone-depletion potential.

関連反応

19 件

関連ノート

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