1,1,1,2-테트라클로로-2,2-디플루오로에탄

1,1,1,2-Tetrachloro-2,2-difluoroethane

HCID 6426CAS 28605-74-5

기본 정보

표준 SMILES
FC(F)(Cl)C(Cl)(Cl)Cl
InChIKey
SLGOCMATMKJJCE-UHFFFAOYSA-N
분자식
C2Cl4F2
평균 분자량
203.8 g/mol
단동위원소 질량
201.87221716

개요

1,1,1,2-tetrachloro-2,2-difluoroethane is a colorless solid with a slight, ether-like odor. mp: 40.6 °C; bp: 91.5 °C.

이름 및 식별자

우선 이름
1,1,1,2-Tetrachloro-2,2-difluoroethane
IUPAC
1,1,1,2-tetrachloro-2,2-difluoroethane
현지명
1,1,1,2-테트라클로로-2,2-디플루오로에탄
영어명
1,1-Difluorotetrachloroethane
분자식
C2Cl4F2
분자량
203.83

이름 및 동의어

1,1-Difluorotetrachloroethane1,1,1,2-TETRACHLORO-2,2-DIFLUOROETHANE1,1,1,2-TetrachlorodifluoroethaneFluorocarbon 112a2,2-Difluoro-1,1,1,2-tetrachloroethaneEthane, 1,1,1,2-tetrachloro-2,2-difluoro-Freon BUHSDB 1092UNII-76ZK8AK9CJEINECS 200-934-0BRN 16994611,2,2,2-Tetrachloro-1,1-difluoroethane
이름 더 보기
1,1,1,2-테트라클로로-2,2-다이플루오로에테인1,1,1,2-테트라클로로-2,2-디플로로에탄1,1,1,2-테트라클로로-2,2-디플루오로에탄1,1,1,2-테트라클로로디플루오로에탄f112ar112acfc112aFron-112afreon112aGenetron131halocarbon112arefrigerant112a
Ethane, 1,1-difluoro-1,2,2,2-tetrachloro-Ethane, 2,2-difluoro-1,1,1,2-tetrachloro-R-112ADTXSID908616224-01-00-00146 (Beilstein Handbook Reference)1,1,1,2-TETRACHLORO-2,2-DIFLUOROETHANE [HSDB]Freon(R) 112aRefChem:70825

데이터베이스 식별자

CAS
28605-74-5、76-11-9
PubChem CID
6426
DTXSID
DTXSID90861622
UNII
76ZK8AK9CJ
EC Number
200-934-0、249-101-3
Nikkaji
J34.801E

물성

구조 계산 물성

XLogP
3.4
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
2
회전 가능 결합 수
0
무거운 원자 수
8

실험 및 물리화학적 성질

SolventsSolvents -> Chlorofluorocarbons
SpringerMaterials PropertiesBoiling point
LogP3.41
Odor · 2건

Slight ether odor

Slight ether-like odor

Density · 6건

1.65 (NIOSH, 2024) - Denser than water; will sink

1.649 g/cu cm at 25 °C

Liquid density = 1.649 g/ml at 20 °C

Density (at 25 °C): 1.65 g/cm³

1.65

1.65

Viscosity2.1583X10-3 Pa.s at 313.75 K

물리화학적 성질

녹는점
39 · 39-44 °C
끓는 점
91 · 91-91 °C
밀도
1.64 · 1.64
증기압
40 at · 40 at 20 °C (NIOSH, 1997)
굴절률
1.4046 · 1.4046
인화점
90 · 90-92°C

화학적 성질

colorless crystalline solid

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 3건

Chemical: Ethane, 1,1,1,2-tetrachloro-2,2-difluoro-

Chemical: Ethane, tetrachlorodifluoro-

1,1,1,2-Tetrachloro-2,2-difluoroethane: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
DOT LabelNon-Flammable Gas
Fire Hazards · 2건

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

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

Health HazardsExcerpt from NIOSH Pocket Guide for 1,1,1,2-Tetrachloro-2,2-difluoroethane:
Hazards SummaryRats exposed to 10,000 ppm for 2 hours show signs of intoxication. At 20,000 to 30,000 ppm, all rats die within 1.5 to 2 hours. There are signs of kidney and liver injury, but no signs of pulmonary injury. [ACGIH] See CHLOROFLUOROCARBONS;

안전 및 보호

Fire Fighting · 2건

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

In case of fire in the surroundings, use appropriate extinguishing media.

First Aid Measures · 4건

Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer for medical attention.

Rinse and then wash skin with water and soap.

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

Rinse mouth.

First Aid · 2건

Excerpt from NIOSH Pocket Guide for 1,1,1,2-Tetrachloro-2,2-difluoroethane:

(General first aid procedures)

Safe StorageSee Chemical Dangers. Well closed.
Exposure Control and Personal Protection200.0 [ppm]
Fire Fighting ProceduresIn case of fire in the surroundings, use appropriate extinguishing media.

독성 정보

Target OrgansEyes, skin, respiratory system, central nervous system
Environmental Fate · 3건

TERRESTRIAL FATE: Based on a classification scheme(1), an estimated Koc value of 200(SRC), determined from a structure estimation method(2), indicates that 1,1,1,2-tetrachloro-2,2-difluoroethane is expected to have moderate mobility in soil(SRC). Volatilization of 1,1,1,2-tetrachloro-2,2-difluoroethane from moist soil surfaces is expected to be an important fate process(SRC) given an estimated Henry's Law constant of 1.6X10-1 atm-cu m/mole, derived from its vapor pressure, 60 mm Hg(4), and water solubility, 100 mg/L(5). The potential for volatilization of 1,1,1,2-tetrachloro-2,2-difluoroethane from dry soil surfaces may exist, based upon a vapor pressure of 60 mm Hg(4). Structurally similar compounds such as Freon 12 and Freon 114 have been shown to biodegrade under anaerobic conditions(6), suggesting that 1,1,1,2-tetrachloro-2,2-difluoroethane may also biodegrade under anaerobic conditions(SRC).

AQUATIC FATE: Based on a classification scheme(1), an estimated Koc value of 200(SRC), determined from an estimation method(2), indicates that 1,1,1,2-tetrachloro-2,2-difluoroethane may moderately adsorb to suspended solids and sediment(SRC). Volatilization from water surfaces is expected(3) based upon an estimated Henry's Law constant of 1.6X10-1 atm-cu m/mole, derived from its vapor pressure, 60 mm Hg(4), and water solubility, 100 mg/L(8). Using this Henry's Law constant and an estimation method(3), volatilization half-lives for a model river and model lake are 1.5 hours and 5.7 days, respectively(SRC). According to a classification scheme(5), an estimated BCF of 82(SRC), from an estimated log Kow of 3.41(6) and a regression-derived equation(7), suggests the potential for bioconcentration in aquatic organisms is moderate. Structurally similar compounds such as Freon 12 and Freon 114 have been shown to biodegrade under anaerobic conditions(9), suggesting that 1,1,1,2-tetrachloro-2,2-difluoroethane may also biodegrade under anaerobic conditions(SRC).

ATMOSPHERIC FATE: According to a model of gas/particle partitioning of semivolatile organic compounds in the atmosphere(1), 1,1,1,2-tetrachloro-2,2-difluoroethane, which has a vapor pressure of 60 mm Hg at 25 °C(2), is expected to exist solely as a vapor in the ambient atmosphere. 1,1,1,2-Tetrachloro-2,2-difluoroethane is not expected to degrade in the troposphere. As a result, it will disperse and slowly diffuse to the stratosphere, a process that may take decades(3). By analogy to other chlorofluorocarbons(5), 1,1,1,2-tetrachloro-2,2-difluoroethane will slowly photolyze in the stratosphere, releasing chlorine atoms which in turn are responsible for removing ozone(4). While some 1,1,1,2-tetrachloro-2,2-difluoroethane may be lost from the atmosphere by being scavenged by rain, any loss will be returned to the atmosphere by volatilization(SRC). 1,1,1,2-Tetrachloro-2,2-difluoroethane does not contain any chromophores that absorb solar radiation >290 nm and, therefore, it is not susceptible to direct photolysis in the troposphere(SRC).

Adverse EffectsNeurotoxin - Acute solvent syndrome
Exposure Routes · 2건

The substance can be absorbed into the body by inhalation of its vapour.

inhalation, ingestion, skin and/or eye contact

Signs and Symptoms · 2건

Cough. Sore throat. Laboured breathing. Shortness of breath. Irregular heartbeat. Confusion. Drowsiness. Unconsciousness.

irritation eyes, skin; central nervous system depression; pulmonary edema; drowsiness; dyspnea (breathing difficulty)

ICSC Environmental DataAvoid release to the environment because of its impact on the ozone layer.

규제 정보

FDA Requirements · 2건

The Food and Drug Administration (FDA), after consultation with the Environmental Protection Agency (EPA), is amending FDA's regulation on the use of ozone-depleting substances (ODSs) in selfpressurized containers to remove the essential-use designations for flunisolide, triamcinolone, metaproterenol, pirbuterol, albuterol and ipratropium in combination, cromolyn, and nedocromil used in oral pressurized metered-dose inhalers (MDIs). The Clean Air Act requires FDA, in consultation with the EPA, to determine whether an FDA-regulated product that releases an ODS is an essential use of the ODS. FDA has concluded that there are no substantial technical barriers to formulating flunisolide, triamcinolone, metaproterenol, pirbuterol, albuterol and ipratropium in combination, cromolyn, and nedocromil as products that do not release ODSs, and therefore they will no longer be essential uses of ODSs as of the effective dates of this rule. MDIs for these active moieties containing an ODS may not be marketed after the relevant effective date. DATES: Removal of Part 2.125(e)(2)(iii) and 2.125(e)(4)(vii) is effective June 14, 2010. Removal of Part 2.125(e)(1)(v) and 2.125(e)(4)(iv) is effective December 31, 2010. Removal of Part 2.125(e)(1)(iii) is effective June 30, 2011. Removal of 2.125(e)(2)(iv) and Part 2.125(e)(4)(viii) is effective December 31, 2013. /Ozone-Depleting Substances/

Use of ozone-depleting substances in foods, drugs, devices, or cosmetics. (a) As used in this section, ozone-depleting substance (ODS) means any class I substance as defined in 40 CFR part 82, appendix A to subpart A, or class II substance as defined in 40 CFR part 82, appendix B to subpart A. (b) Except as provided in paragraph (c) of this section, any food, drug, device, or cosmetic that is, consists in part of, or is contained in an aerosol product or other pressurized dispenser that releases an ODS is not an essential use of the ODS under the Clean Air Act. (c) A food, drug, device, or cosmetic that is, consists in part of, or is contained in an aerosol product or other pressurized dispenser that releases an ODS is an essential use of the ODS under the Clean Air Act if paragraph (e) of this section specifies the use of that product as essential. For drugs, including biologics and animal drugs, and for devices, an investigational application or an approved marketing application must be in effect, as applicable. ... (e) The use of ODSs in the following products is essential: ... (2) Metered-dose short-acting adrenergic bronchodilator human drugs for oral inhalation. Oral pressurized metered-dose inhalers containing the following active moieties: ... (iv) Pirbuterol. ... (4) Other essential uses. (iii) Anesthetic drugs for topical use on accessible mucous membranes of humans where a cannula is used for application. ... (vi) Metered-dose atropine sulfate aerosol human drugs administered by oral inhalation. ... (viii) Metered-dose ipratropium bromide and albuterol sulfate, in combination, administered by oral inhalation for human use. (ix) Sterile aerosol talc administered intrapleurally by thoracoscopy for human use. /Ozone-Depleting Substances/

안전 데이터

OEB
A
OEL
TWA: 500 ppm (4170 mg/m3)
IDLA
2,000 ppm
tsca
TSCA listed
독성
LD50 oral in rat: > 8gm/kg
HS 번호
29034520

화학 및 산업

약리 정보

Absorption, Distribution and Excretion · 3건

... Main factor affecting fate of fluorocarbons is body fat, where they are concentrated & slowly released into blood at concn that should not cause any risk of cardiac sensitization.

There is a significant accumulation of propellant in the brain, liver and lung compared to blood levels, signifying a tissue distribution of propellant similar to that of chloroform. /Fluorocarbons/

Regardless of the route of entry, chlorofluorocarbons appear to be eliminated almost exclusively through the respiratory tract. Little, if any, chlorofluorocarbon or metabolite has ever been reported in urine or feces. /Chlorofluorocarbons/

용도 및 제조

Uses · 3건

CFC-112a has been used as a refrigerant. [ACGIH] Use in dry cleaning industry; in polymer & plastics industry as blowing or foaming agent; as solvent extractor for separation & purification of biological material; as a dye solvent to give brighter colors and to detect surface cracks or defects in metals; as a corrosion inhibitor.; [HSDB]

See CHLOROFLUOROCARBONS

CFC 112a has been used primarily as a refrigerant and also as a solvent, corrosion inhibitor, and foam-blowing agent.

Impurities · 1건

Chlorofluoroalkanes (and also the alternative HCFCs and HFCs) produced on an industrial scale are subject to stringent standards. Impurities must not exceed the following limits (vol %): acids, 0; moisture, <0.001; higher-boiling fractions, <0.05; and other gases, 2. /Chlorofluoroalkanes/

U.S. Production · 2건

(1972) LESS THAN 4.54X10+5 GRAMS

(1975) LESS THAN 4.54X10+5 GRAMS

Methods of Manufacturing · 1건

The most important commercial method for manufacturing CFCs and HCFCs is the successive replacement of chlorine by fluorine using hydrogen fluoride. The traditional, liquid-phase process uses antimony pentafluoride or a mixture of antimony trifluoride and chlorine as catalysts. Continuous vapor-phase processes that employ gaseous hydrogen fluoride in the presence of heterogenous chromium, iron, or fluorinated alumina catalysts also are widely used. Carbon tetrachloride, chloroform, and hexachloroethane (or tetrachloroethylene plus chlorine) are commonly used starting materials for one- and two-carbon chlorofluorocarbons. The extent of chlorine exchange can be controlled by varying the hydrogen fluoride concentration, the contact time, or the reaction temperature. /CFCs and HCFCs/

Formulations/PreparationsGrades: purified; solvent
General Manufacturing Information · 6건

Ethane, 1,1,1,2-tetrachloro-2,2-difluoro-: ACTIVE

Ethane, tetrachlorodifluoro-: INACTIVE

SRP: The EPA has organized groups of chemicals into two classes according to their ozone-depletion potential. Class I controlled substances are those with an ozone-depletion potential of 0.2 or higher. Class II controlled substances are those with an ozone-potential of less than 0.2. Class II controlled substances are all hydrochlorofluorocarbons (HCFCs).

Class I Controlled Substance: C2F2Cl4 (CFC-112) /and all isomers/: Ozone-depletion potential: 1.0.

In the United States, "Class I" substances were subject to the first round of phaseout targets. Class I substances have an ozone depletion potential (ODP) of 0.2 or higher, and include halons, chlorofluorocarbons (CFCs), methyl chloroform, carbon tetrachloride, and methyl bromide. Section 604 of the Clean Air Act sets the phaseout targets for Class I substances. The ban on production and import of halons took effect on January 1, 1994. The ban on production and import of other Class I ODS /ozone-depleting substance/ - excluding methyl bromide - took effect on January 1, 1996.

... /The use of chlorofluorocarbons for aerosol sprays/ was prohibited in 1979 except for a few specialized items, because of their depleting effect on stratospheric ozone. /Chlorofluorocarbons/

응용 분야

용도Refrigerant.

일반 설명Colorless solid with a slight, ether-like odor. [Mp: 40.6°C; bp: 91.5°C.

관련 반응

3건

연결된 노트

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