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Perfluoropropane

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Name

Perfluoropropane

EINECS 200-941-9
CAS No. 76-19-7 Density 1.543 g/cm3
PSA 0.00000 LogP 2.74630
Solubility N/A Melting Point -183 °C
Formula C3F8 Boiling Point -39 °C
Molecular Weight 188.02 Flash Point N/A
Transport Information N/A Appearance colorless, odorless gas
Safety 9-23-38 Risk Codes N/A
Molecular Structure Molecular Structure of 76-19-7 (Perfluoropropane) Hazard Symbols FlammableF
Synonyms

Propane,octafluoro- (6CI,8CI,9CI);DMP 115;Definity;F 218;FC 218;FC 218(refrigerant);FS 069;Freon 218;Genetron 218;HFC 218;Khladon 218;MRH 815H;MRX 115;Meforex 218;Octafluoropropane;Optison;PFC 218;Perfluoropropane;Perflutren;R 218;UN 2424;YM 454;Meforex 218;Octafluoropropane;Propane, 1,1,1,2,2,3,3,3-octafluoro-;,1,1,2,2,3,3,3-octafluoropropane;

Article Data 104

Perfluoropropane Synthetic route

116-15-4

perfluoropropylene

76-19-7

freon-218

Conditions
ConditionsYield
With xenon difluoride; silicon tetrafluoride at 90℃; for 13h; Fluorination;95%
With nickel(II) fluoride; fluorine at 100℃;62%
With AgFAsF6 In hydrogen fluoride at -196 - -70℃; for 0.0833333h; Yield given;
With cobalt (III) fluoride; Hexafluoroethane at 92℃; for 0.0333333h; Rate constant; Product distribution; var. time, var. temp.;
With fluorine at -20℃; under 1125.11 Torr; for 7.22222E-06h;
463-49-0

1,2-propanediene

A

75-73-0

carbon tetrafluoride

B

76-19-7

freon-218

Conditions
ConditionsYield
With fluorine; sodium fluoride at -100 - -10℃; for 12h;A n/a
B 84%
116-15-4

perfluoropropylene

A

428-59-1

Hexafluoropropene oxide

B

76-19-7

freon-218

C

C3F12OSe

D

C3F16O2Se2

Conditions
ConditionsYield
With xenon bis-pentafluoroseleniumoxide at 65℃; for 84h;A 36%
B n/a
C 51%
D 11%
24243-71-8

propane-1-sulfonamide

A

76-19-7

freon-218

B

76-16-4

Hexafluoroethane

C

754-03-0

ethanesulfonyl fluoride

D

423-40-5

1-perfluoropropanesulfonyl fluoride

Conditions
ConditionsYield
With hydrogen fluoride current: 4.5 to 5.5 V; 0.3 to 0.6 Adm-2; Further byproducts given;A 2.8%
B 3.1%
C 4.3%
D 40%
67-64-1

acetone

A

76-19-7

freon-218

B

354-34-7

trifluoroacetyl fluoride

C

684-16-2

Hexafluoroacetone

Conditions
ConditionsYield
With copper; sodium fluoride at -100℃;A n/a
B n/a
C 39%
With copper; sodium fluoride at -100℃; Mechanism;A n/a
B n/a
C 39%
With copper; sodium fluoride at -100℃;
105062-53-1

C3F17IO2Te2

A

76-19-7

freon-218

B

754-34-7

1,1,1,2,2,3,3-heptafluoro-3-iodo-propane

C

91600-26-9

C3F12OTe

D

TeF6

TeF6

Conditions
ConditionsYield
at 115℃; for 26h;A n/a
B n/a
C 30%
D n/a
423-41-6

perfluoropropanesulfonic acid

A

640723-20-2, 2699-79-8, 12769-73-2

fluorosulfonyl fluoride

B

353-50-4

Carbonyl fluoride

C

76-19-7

freon-218

D

422-61-7

perfluoropropanoyl fluoride

E

7446-09-5

sulfur dioxide

Conditions
ConditionsYield
in Pt tube at 500°C, 1 h, incomplete reaction;A n/a
B n/a
C 19%
D 23%
E n/a
142-84-7

di-n-propylamine

A

76-19-7

freon-218

B

423-32-5

N,N-Difluor-heptafluor-n-propylamin

C

356-64-9

2,2,3,3,3-pentafluoro-N-(perfluoropropyl)propanimidoyl fluoride

D

1554-24-1

F-(N-F-Fluoro,N,N-di-n-propylamine)

Conditions
ConditionsYield
With hydrogen fluoride at 7 - 8℃; Fluorination; Cleavage; Electrolysis;A 20.1%
B 1.3%
C 1.8%
D 7.8%
With hydrogen fluoride at 7 - 8℃; for 10.9167h; Fluorination; Cleavage; Electrolysis;A n/a
B n/a
C 1.9%
D 6.2%
75-46-7

trifluoromethan

A

116-14-3

polytetrafluoroethylene

B

75-73-0

carbon tetrafluoride

C

76-19-7

freon-218

D

116-15-4

perfluoropropylene

E

76-16-4

Hexafluoroethane

Conditions
ConditionsYield
With activated carbon supported potassium at 799.84℃; under 750.075 Torr; Pyrolysis; Inert atmosphere;A 16.1%
B n/a
C n/a
D 14.4%
E n/a
20193-20-8

ethylpropylamine

A

76-19-7

freon-218

B

423-32-5

N,N-Difluor-heptafluor-n-propylamin

C

2,2,3,3,3-pentafluoro-N-(1,1,2,2,2-pentafluoro-ethyl)-propionimidoyl fluoride

D

F-(N-Fluoro,N-ethyl,N-n-propylamine)

Conditions
ConditionsYield
With hydrogen fluoride at 7 - 8℃; for 6.55h; Fluorination; Cleavage; Electrolysis;A n/a
B 2.6%
C 2.4%
D 2.8%

Perfluoropropane Specification

The Perfluoropropane, with the CAS registry number 76-19-7 and EINECS registry number 200-941-9, has the systematic nane of octafluoropropane. It belongs to the product categories of Refrigerants and Organics. And the molecular formula of the chemical is C3F8.

The characteristics of Perfluoropropane are as followings: (1)ACD/LogP: 2.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.65; (4)ACD/LogD (pH 7.4): 2.65; (5)ACD/BCF (pH 5.5): 61.32; (6)ACD/BCF (pH 7.4): 61.32; (7)ACD/KOC (pH 5.5): 662.5; (8)ACD/KOC (pH 7.4): 662.5; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.221; (14)Molar Refractivity: 17.15 cm3; (15)Molar Volume: 121.7 cm3; (16)Polarizability: 6.8×10-24cm3; (17)Surface Tension: 9.3 dyne/cm; (18)Density: 1.543 g/cm3; (19)Enthalpy of Vaporization: 20.82 kJ/mol; (20)Vapour Pressure: 6250 mmHg at 25°C.

Perfluoropropane is a kind of colorless, odorless gas. And it is relatively inert. The mixture is nonflammable and nontoxic, though asphyxiation may occur because of displacement of oxygen. Exposure of the container to prolonged heat or fire can cause it to rupture violently and rocket.

Uses of Perfluoropropane: It can react with benzoyl fluoride to produce Heptafluoro-1-methylethyl-phenylketon. This reaction will need reagent CsF, and the menstruum dimethylformamide. The reaction time is 3 hours, and the yield is about 95.1%.

While dealing with this chemical, you had better take the following instructions: Keep container in a well-ventilated place, and do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer). What's more, if in case of insufficient ventilation, wear suitable respiratory equipment.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: FC(F)(F)C(F)(F)C(F)(F)F
(2)InChI: InChI=1/C3F8/c4-1(5,2(6,7)8)3(9,10)11
(3)InChIKey: QYSGYZVSCZSLHT-UHFFFAOYAL

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD intravenous > 20mL/kg (20mL/kg)   International Journal of Toxicology. Vol. 17, Pg. 631, 1998.
monkey LD intravenous > 20mL/kg (20mL/kg)   International Journal of Toxicology. Vol. 17, Pg. 631, 1998.
rabbit LD intramuscular > 217uL/kg (0.217mL/kg) BLOOD: HEMORRHAGE

MUSCULOSKELETAL: OTHER CHANGES
International Journal of Toxicology. Vol. 17, Pg. 631, 1998.
rat LDLo intravenous 25mL/kg (25mL/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

LUNGS, THORAX, OR RESPIRATION: CYANOSIS
International Journal of Toxicology. Vol. 17, Pg. 631, 1998.

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