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Basic Information
CAS No.: 700-16-3
Name: Pentafluoropyridine
Molecular Structure:
Molecular Structure of 700-16-3 (Pentafluoropyridine)
Formula: C5F5N
Molecular Weight: 169.054
Synonyms: 2,3,4,5,6-Pentafluoropyridine;Pyridine,pentafluoro- (6CI,7CI,8CI,9CI);
EINECS: 211-839-9
Density: 1.63 g/cm3
Melting Point: -42 °C
Boiling Point: 100.1 °C at 760 mmHg
Flash Point: 23.9 °C
Solubility: Not miscible or difficult to mix in water.
Appearance: clear colourless liquid
Hazard Symbols: HarmfulXn,FlammableF,IrritantXi
Risk Codes: 10-20/21/22-36/37/38
Safety: 26-28-24/25-16
Transport Information: UN 1993 3/PG 3
PSA: 12.89000
LogP: 1.77710
Synthetic route
2176-62-7

2,3,4,5,6-pentachloropyridine

700-16-3

Pentafluoropyridine

Conditions
ConditionsYield
With potassium fluoride; B(2,2-bis(hydroxymethyl)propionate(3-)) In 1-methyl-pyrrolidin-2-one at 180℃; for 3h; Inert atmosphere;84%
With potassium fluoride at 480℃; for 2h; Product distribution; various temperature, reactant volume, F(1-) ion concentration and contact time;

potassium fluoride

2176-62-7

2,3,4,5,6-pentachloropyridine

700-16-3

Pentafluoropyridine

Conditions
ConditionsYield
In neat (no solvent) molar ratio C5Cl5N/KF = 1/20.0, 500 °C, 18 h;;83%
In neat (no solvent) molar ratio C5Cl5N/KF = 1/20.0, 500 °C, 18 h;;83%
In neat (no solvent) weight-ratio KF/C5Cl5N = 8/3, 450 °C, 24 h;;68.5%
57310-43-7

4-N,N-dichloroamino-2,3,5,6-tetrafluoropyridine

A

675-14-9

trifluoro-[1,3,5]triazine

B

52026-98-9

4-chloro-2,3,5,6-tetrafluoropyridine

C

700-16-3

Pentafluoropyridine

D

75-69-4

trichlorofluoromethane

E

667-42-5

2-chloro-3,3-difluoro-acrylonitrile

F

13177-77-0

tetrafluoropyrazine

Conditions
ConditionsYield
at 550℃; under 2 Torr; Mechanism; vacuum pyrolysis, other fluoropyridine compounds;A n/a
B 75%
C n/a
D n/a
E n/a
F n/a

potassium fluoride

2176-62-7

2,3,4,5,6-pentachloropyridine

A

700-16-3

Pentafluoropyridine

B

1735-84-8

3-chloro-2,4,5,6-tetrafluoropyridine

C

1737-93-5

3,5-dichloro-2,4,6-trifluoropyridine

Conditions
ConditionsYield
In neat (no solvent) autoclave, 470 °C (12 h), 2-fold molar excess of KF;;A 65%
B 18%
C 5%
In neat (no solvent) autoclave, 470 °C (12 h), 2-fold molar excess of KF;;A 65%
B 18%
C 5%
In neat (no solvent) 450 °C, excess of KF;;A 40%
B n/a
C n/a
1737-93-5

3,5-dichloro-2,4,6-trifluoropyridine

A

700-16-3

Pentafluoropyridine

B

1735-84-8

3-chloro-2,4,5,6-tetrafluoropyridine

Conditions
ConditionsYield
With potassium fluoride; tetraphenylphosphonium bromide In sulfolane at 200℃; for 7h; Fluorination;A 21%
B 61%
With potassium fluoride In sulfolane; chlorobenzene at 215℃; for 22h;
With potassium fluoride; tetraphenylphosphonium bromide In sulfolane; chlorobenzene at 215℃; for 22h;

potassium fluoride

C5Cl2F3N

A

700-16-3

Pentafluoropyridine

B

C5ClF4N

Conditions
ConditionsYield
In sulfolane 223-227 °C (10 h);;A 21%
B 50%
In sulfolane 223-227 °C (10 h);;A 21%
B 50%
110-86-1

pyridine

A

2344-10-7

perfluoro-N-ethylpyrrolidine

B

3512-16-1

2,3,4,5-tetrafluoropyridine

C

700-16-3

Pentafluoropyridine

D

371-77-7

N,N-Bis(trifluoromethyl)amine

Conditions
ConditionsYield
With caesium tetrafluorocobaltate(III) In gaseous matrix at 395 - 405℃; for 0.5h; Further byproducts given;A 32.9%
B 3.9%
C 39.9%
D 8.5%
With caesium tetrafluorocobaltate(III) In gaseous matrix at 310℃; for 3.5h; Further byproducts given;A 35.3%
B 5.3%
C 13.6%
D 8.2%
110-89-4

piperidine

2176-62-7

2,3,4,5,6-pentachloropyridine

A

700-16-3

Pentafluoropyridine

B

1735-84-8

3-chloro-2,4,5,6-tetrafluoropyridine

C

1737-93-5

3,5-dichloro-2,4,6-trifluoropyridine

D

34415-32-2

2,3,5,6-tetrachloro-4-fluoropyridine

Conditions
ConditionsYield
With cesium fluoride In N,N-dimethyl-formamide at 80℃; for 9h; Product distribution; other reagents;A 2%
B 4%
C 9%
D 39%
110-86-1

pyridine

A

2344-10-7

perfluoro-N-ethylpyrrolidine

B

1513-66-2

2,3-difluoropyridine

C

700-16-3

Pentafluoropyridine

D

371-77-7

N,N-Bis(trifluoromethyl)amine

Conditions
ConditionsYield
With caesium tetrafluorocobaltate(III) In gaseous matrix at 310℃; for 3.5h; Further byproducts given;A 35.3%
B 2.2%
C 13.6%
D 8.2%
110-86-1

pyridine

A

2344-10-7

perfluoro-N-ethylpyrrolidine

B

3512-18-3

2,3,6-trifluoropyridine

C

3512-16-1

2,3,4,5-tetrafluoropyridine

D

700-16-3

Pentafluoropyridine

E

371-77-7

N,N-Bis(trifluoromethyl)amine

F

tetrafluoro-3-(fluoromethyl)pyridine

Conditions
ConditionsYield
With caesium tetrafluorocobaltate(III) In gaseous matrix at 310℃; for 3.5h; Product distribution; other reactor geometry, temperature, time;A 35.3%
B 3.2%
C 5.3%
D 13.6%
E 8.2%
F 2.7%
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Chemistry

Molecular structure of Pentafluoropyridine (CAS NO.700-16-3):

MF
: C5F5N
MW: 169.052216 g/mol
EINECS: 211-839-9
Melting Point: -42
Density: 1.63 g/cm
Flash Point: 23.9 °C 
Enthalpy of Vaporization: 32.54 kJ/mol 
Boiling Point: 100.1 °C at 760 mmHg 
Vapour Pressure: 42.8 mmHg at 25°C
IUPAC Name
: 2,3,4,5,6-pentafluoropyridine
Chemical Properties of Pentafluoropyridine (CAS NO.700-16-3): Clear colourless loquid
Product Categories: Pyridines, Pyrimidines, Purines and Pteredines ; Pyridine ; Fluoropyridines ; Halopyridines ; C5 ; Heterocyclic Building Blocks ; Pyridines

Safety Profile

Safety Information of Pentafluoropyridine (700-16-3):
Hazard Codes  Xn,F,Xi
Xn: Harmful Xi: Irritant C: Corrosive
Risk Statements: 10-20/21/22-36/37/38
10:  Flammable 
20/21/22: Harmful by inhalation, in contact with skin and if swallowed 
36/37/38: Irritating to eyes, respiratory system and skin 
Safety Statements: 26-28-24/25-16
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
28: After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 
24/25: Avoid contact with skin and eyes 
16: Keep away from sources of ignition - No smoking 
RIDADR  UN 1993 3/PG 3
WGK Germany: 3
Hazard Note:  Flammable/Irritant
HazardClass: 3
PackingGroup: III

Specification

 Pentafluoropyridine , its CAS NO. is 700-16-3, the synonyms are  2,3,4,5,6-  Pentafluoropyridine ; Pentafluoropyridine ; Perfluoropyridine ; Pentafluoropyridine, 99+% ; Pentafluoropyridine 99% ; 5-Chloro-2-caynopyridine .