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ChemicalBook--->CAS DataBase List--->76-13-1

76-13-1

76-13-1 Structure

76-13-1 Structure
IdentificationMore
[Name]

1,1,2-Trichlorotrifluoroethane
[CAS]

76-13-1
[Synonyms]

1,1,2-TRICHLORO-1,2,2-TRIFLUOROETHANE
1,1,2-Trichloro-1,2,2-trifluroethane
1,1,2-TRICHLOROTRIFLUOROETHANE
1,1,2-TRIFLUOROTRICHLOROETHANE
1,1,2-Trifluorotriehloroethane
1,2,2-TRIFLUOROTRICHLOROETHANE
1,l,2-Trifluorotrichloroethane
CFC-113
FC-113
Fluorocarbon 113
FREON
FREON 113
Froen-113
GENETRON(R) 113
'GENETRON(R) 113'
HALOCARBON 113
R113
Refrigerant 113
Trifluorotrichloroethane
1,1,2-Trichlor-1,2,2-trifluorethan
[EINECS(EC#)]

200-936-1
[Molecular Formula]

C2Cl3F3
[MDL Number]

MFCD00000782
[Molecular Weight]

187.38
[MOL File]

76-13-1.mol
Chemical PropertiesBack Directory
[Appearance]

TTE is a colorless liquid. Carbon tetrachloride-like odor at high concentrations. A gas above 48℃.
[Melting point ]

−35 °C(lit.)
[Boiling point ]

47-48 °C(lit.)
[density ]

1.57 g/mL at 25 °C(lit.)
[vapor density ]

6.5 (vs air)
[vapor pressure ]

5.5 psi ( 20 °C)
[refractive index ]

n20/D 1.358(lit.)
[Fp ]

195°C
[storage temp. ]

2-8°C
[solubility ]

0.17g/l
[form ]

Colorless gas; volatile liquid.
[Stability:]

Stable. Non-flammable. Incompatible with alkali metals, chemically active metals, magnesium, zinc, aluminium.
[Water Solubility ]

0.02 g/100 mL. Slightly soluble
[BRN ]

1740335
[Henry's Law Constant]

0.154, 0.215, 0.245, 0.319, and 0.321 at 10, 15, 20, 25, and 30 °C, respectively (EPICS, Ashworth et al., 1988)
[Dielectric constant]

2.6(21℃)
[Exposure limits]

TLV-TWA 1000 ppm (~7600 mg/m3) (ACGIH, MSHA, and OSHA); TLV-STEL 1250 ppm (ACGIH).
[LogP]

3.160
[Uses]

Dry-cleaning solvent, fire extinguishers, to make chlorotrifluoroethylene, blowing agent, polymer intermediate, solvent drying, drying electronic parts and precision equipment.
[CAS DataBase Reference]

76-13-1(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethane, 1,1,2-trichloro-1,2,2-trifluoro-(76-13-1)
[EPA Substance Registry System]

76-13-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

N,Xi,T
[Risk Statements ]

R52/53:Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R59:Dangerous for the ozone layer.
R39/23/24/25:Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S59:Refer to manufacturer/supplier for information on recovery/recycling .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

UN 3082 9/PG 3
[WGK Germany ]

2
[RTECS ]

KJ4000000
[Autoignition Temperature]

1256 °F
[Hazard Note ]

Irritant
[Safety Profile]

Mildly toxic by ingestion and inhalation. Affects the central nervous system in humans. A sktn irritant. Combustible when exposed to heat or flame. Incompatible with Al, Ba, Li, Sm, NaK alloy, Ti. See also CHLORINATED HYDROCARBONS, ALIPHATIC; and FLUORIDES.
[Hazardous Substances Data]

76-13-1(Hazardous Substances Data)
[Toxicity]

Acute oral LD50 for rats 43 mg/kg (quoted, RTECS, 1985).
[IDLA]

2,000 ppm
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Hydrogen fluoride-->Hexachloroethane-->3-CHLOROPENTAFLUOROPROPENE-->1,2-DICHLOROHEXAFLUOROCYCLOBUTANE-->1,2-DICHLORO-1,2-DIFLUOROETHYLENE-->Octafluoro-1-butene-->Octafluorocyclobutane
[Preparation Products]

Cleaning agent-->5-Fluoro-2-picolinic acid-->1,2-DIFLUOROTETRACHLOROETHANE-->3,4-Dichloropyridine-->methyl 3-(2-chloro-3,3,3-trifluoro-1-propenyl)-2,2-di-methyl-cyclopropane carboxylate-->1,2-DICHLOROTETRAFLUOROETHANE-->Chlorotrifluoroethylene-->Halothane-->1,2-DICHLOROTRIFLUOROETHANE-->1,1,1-Trichlorotrifluoroethane
Hazard InformationBack Directory
[General Description]

Colorless liquid with a sweet, ether-like odor. Sinks in water.
[Reactivity Profile]

1,1,2-TRICHLORO-1,2,2-TRIFLUOROETHANE(76-13-1) yields violent reactions with Al, Ba, Li, Sm, Na/K alloy and Ti . May react exothermically with aluminum.
[Air & Water Reactions]

Insoluble in water.
[Health Hazard]

Inhalation causes irritation of the nose, throat, and lungs. High concentrations may cause death by respiratory failure or asphyxiation. May produce superficial skin burns or defatting type dermatitis and may irritate the eyes.
[Potential Exposure]

TTE is used as a solvent and refrigerant; it is used in fire extinguishers; as a blowing agent and as an intermediate in the production of chlorotrifluoroethylene monomer by reaction with zinc.
[First aid]

If this chemical gets into the eyes, remove any contact lenses at once and irrigate immediately for at least 15 minutes, occasionally lifting upper and lower lids. Seek medical attention immediately. If this chemical contacts the skin, remove contaminated clothing and wash immediately with soap and water. Seek medical attention immediately. If this chemical has been inhaled, remove from exposure, begin rescue breathing (using universal precautions, including resuscitation mask) if breathing has stopped and CPR if heart action has stopped. Transfer promptly to a medical facility. When this chemical has been swallowed, get medical attention. Give large quantities of water and induce vomiting. Do not make an unconscious person vomit. If frostbite has occurred, seek medical attention immediately; do NOT rub the affected areas or flush them with water. In order to prevent further tissue damage, do NOT attempt to remove frozen clothing from frostbitten areas. If frostbite has NOT occurred, immediately and thoroughly wash contaminated skin with soap and water.
[Shipping]

UN3082 Environmentally hazardous substances, liquid, n.o.s., Hazard class: 9; Labels: 9-Miscellaneous hazardous material, Technical Name Required.
[Incompatibilities]

Violent reaction with chemically active metals (such as powdered aluminum; beryllium, magnesium and zinc); calcium. Contact with alloys containing more than 2% magnesium causes decomposition, releasing hydrogen chloride, hydrogen fluoride; and carbon monoxide. May react exothermically with aluminum.
[Chemical Properties]

colourless liquid or gas
[Chemical Properties]

TTE is a colorless liquid. Carbon tetrachloride-like odor at high concentrations. A gas above 48℃.
[Waste Disposal]

Incineration, preferably after mixing with another combustible fuel. Care must be exercised to assure complete combustion to prevent the formation of phosgene. An acid scrubber is necessary to remove the halo acids produced.
[Physical properties]

Clear, colorless liquid with a carbon tetrachloride-like odor at high concentrations
[Definition]

ChEBI: 1,1,2-Trichlorotrifluoroethane is a chlorofluorocarbon and a haloalkane. It has a role as a refrigerant.
[Fire Hazard]

Noncombustible liquid.
[Industrial uses]

1,1,2-Trichlorotrifluoroethane (CFC 113) is generally a stable molecule not prone to the reactivity that is often shown by the chlorinated hydrocarbons. The solvent blends that contain the fluorinated hydrocarbon and an alcohol display some metal reactivity which is inhibited by adding nitromethane as a stabilizer.
[Carcinogenicity]

A 2 year inhalation toxicity study/carcinogenicity study was conducted by Trochimowicz et al. in which groups of 100 male and 100 female rats were exposed to levels of up to of 20,000 ppm of CFC 113 6 h/day, 5 days/week for 2 years. Although five nasal tumors were seen, one at 20,000 ppm and four at 10,000 ppm, all five were different morphological types and were judged not to be exposure related. In addition, there was a small increase (5.8%) in pancreatic islet cell adenomas in the females exposed to 20,000 ppm; however, this was within the normal control range.
In a second study, injection of 0.1mLof 10% CFC 113 was not carcinogenic. But when given with a 5% solution of piperonyl butoxide, hepatomas were induced in male mice. The significance of this experimental finding has never been determined.
[Environmental Fate]

Biological. In an anoxic aquifer beneath a landfill in Ottawa, Ontario, Canada, there was evidence to suggest that 1,1,2-trichlorotrifluoroethane underwent reductive dehalogenation to give 1,2-difluoro-1,1,2-trichloroethylene and 1,2-dichloro-1,1,2-trifluoroethane. It was proposed that the latter compound was degraded via dehydrodehalogenation to give 1-chloro-1,1,2-trifluoroethylene (Lesage et al., 1990).
Chemical/Physical. 1,1,2-Trichlorotrifluoroethane will not hydrolyze to any reasonable extent (Kollig, 1993).
[Purification Methods]

Wash it with water, then with weak alkali. Dry it with CaCl2 or H2SO4 and distil it. [Locke et al. J Am Chem Soc 56 1726 1934, Beilstein 1 III 157, 1 IV 142.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,1,2-trifluorotrichloroethane(76-13-1).msds
Spectrum DetailBack Directory
[Spectrum Detail]

1,1,2-Trichlorotrifluoroethane(76-13-1)MS
1,1,2-Trichlorotrifluoroethane(76-13-1)13CNMR
1,1,2-Trichlorotrifluoroethane(76-13-1)IR1
1,1,2-Trichlorotrifluoroethane(76-13-1)Raman
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