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HEXAFLUOROACETONE

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HEXAFLUOROACETONE

EINECS 211-676-3
CAS No. 684-16-2 Density 1,32 g/cm3
PSA 17.07000 LogP 1.68010
Solubility N/A Melting Point -129 ºC
Formula C3F6 O Boiling Point -26 ºC
Molecular Weight 166.023 Flash Point N/A
Transport Information UN 2420 Appearance generally supplied as liquid under pressure
Safety A poison by ingestion. Moderately toxic by inhalation. A poisonous irritant to the skin, eyes, and mucous membranes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits toxic fumes of F. See also FLUORINE and FLUORIDES. Risk Codes R60;R14;R23/24/25;R34;R63   
Molecular Structure Molecular Structure of 684-16-2 (Hexafluoroacetone) Hazard Symbols
Synonyms

2-Propanone,hexafluoro- (6CI); 1,1,1,3,3,3-Hexafluoro-2-propanone;1,1,1,3,3,3-Hexafluoroacetone; Bis(trifluoromethyl) ketone; GC 7887;Hexafluoro-2-propanone; Hexafluoroacetone; NSC 202438; Perfluoro-2-propanone;Perfluoroacetone

Article Data 108

HEXAFLUOROACETONE Chemical Properties

Hexafluoroacetone(684-16-2) is a chemical compound with the formula CF3-CO-CF3. It is structurally similar to acetone, however its reactivity is markedly different. It comes in the form of a colourless, hygroscopic, nonflammable, highly reactive gas characterized by a musty odour. The most common form of this substance is hexafluoroacetone sesquihydrate (1.5 H2O), which is a gem-diol.
IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-one
Molecular formula: C3F6O
Molar mass: 166.02 g/mol
Appearance: Colorless gas
Density: 1.32 g/ml, liquid
Melting point: -129 °C (144 K)
Boiling point: -28 °C (245 K)
Solubility in water: Reacts with water
Other names: perfluoroacetone, acetone hexafluoride, perfluoro-2-propanone
The Structure of HEXAFLUOROACETONE(684-16-2):

HEXAFLUOROACETONE Uses

Hexafluoroacetone(684-16-2) is mostly employed in organic synthesis, but it is also the main chemical intermediate used in the production of hexafluoroisopropanol, as well as polymethyl methacrylates and polyesters for textile coating. Hexafluoroacetone(684-16-2) can be employed as a solvent for acetal resins, polyamides and polyglycolide or as a polymer adhesive.

HEXAFLUOROACETONE Production

Hexafluoroacetone(684-16-2) is prepared in a two step process from perfluoropropene. In the first step KF catalyzes the reaction of the alkene with elemental sulfur to give the 1,3-dithete [(CF3)2CS]2. This species is then oxidized by iodate to give (CF3)2CO.

HEXAFLUOROACETONE Toxicity Data With Reference

1.   

skn-rat TDLo:55 mg/kg (6-16D preg):TER

   TXAPA9    Toxicology and Applied Pharmacology. 41 (1977),195.
2.   

skn-rat TDLo:100 mg/kg (6-15D preg):REP

   FAATDF    Fundamental and Applied Toxicology. 2 (1982),73.
3.   

orl-rat LDLo:191 mg/kg

   TXAPA9    Toxicology and Applied Pharmacology. 6 (1964),341.
4.   

ihl-rat LC50:275 ppm/3H

   TXAPA9    Toxicology and Applied Pharmacology. 6 (1964),341.

HEXAFLUOROACETONE Consensus Reports

Reported in EPA TSCA Inventory.

HEXAFLUOROACETONE Safety Profile

A poison by ingestion. Moderately toxic by inhalation. A poisonous irritant to the skin, eyes, and mucous membranes. An experimental teratogen. Other experimental reproductive effects. When heated to decomposition it emits toxic fumes of F. See also FLUORINE and FLUORIDES.
Hazard Codes: T
Risk Statements: 60-14-23/24/25-34-63
60:  May impair fertility 
14:  Reacts violently with water 
23/24/25:  Toxic by inhalation, in contact with skin and if swallowed 
34:  Causes burns 
63:  Possible risk of harm to the unborn child 
Safety Statements: 53-26-28-36-45-7/9
53:  Avoid exposure - obtain special instruction before use 
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36:  Wear suitable protective clothing 
45:  In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
7/9:  Keep container tightly closed and in a well-ventilated place 
RIDADR: UN 2420 2.3
WGK Germany: 3
RTECS: UC2450000
Hazard Note: Highly Toxic
TSCA: T
HazardClass: 2.3

HEXAFLUOROACETONE Standards and Recommendations

OSHA PEL: TWA 0.1 ppm (skin)
ACGIH TLV: TWA 0.1 ppm (skin)
DOT Classification:  2.3; Label: Poison Gas
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