2,2,3,4,4,4-HEXAFLUORO-1-BUTANOL Chemical Properties

Melting point:

68°C

Boiling point:

114 °C/740 mmHg (lit.)

Density 

1.557 g/mL at 25 °C (lit.)

refractive index 

n20/D 1.312(lit.)

Flash point:

125 °F

storage temp. 

2-8°C

form 

clear liquid

pka

13.10±0.10(Predicted)

Specific Gravity

1.557

color 

Colorless to Light yellow

BRN 

1753872

InChI

InChI=1S/C4H4F6O/c5-2(4(8,9)10)3(6,7)1-11/h2,11H,1H2

InChIKey

LVFXLZRISXUAIL-UHFFFAOYSA-N

SMILES

C(O)C(F)(F)C(F)C(F)(F)F

CAS DataBase Reference

382-31-0(CAS DataBase Reference)

EPA Substance Registry System

1-Butanol, 2,2,3,4,4,4-hexafluoro- (382-31-0)

Safety Information

Hazard Codes 

Xn,Xi,F

Risk Statements 

20/22-36/37/38

Safety Statements 

26-36/37/39

RIDADR 

UN 1987 3/PG 3

WGK Germany 

3

Hazard Note 

Irritant

HazardClass 

3

PackingGroup 

III

HS Code 

29055900

Storage Class

10 - Combustible liquids

Hazard Classifications

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

MSDS

• Language:English Provider:SigmaAldrich
• Language:English Provider:ALFA

2,2,3,4,4,4-HEXAFLUORO-1-BUTANOL Usage And Synthesis

Chemical Properties

Colorless liquid

Uses

2,2,3,4,4,4-Hexafluoro-1-butanol may be used in the preparation of fluorinated cationic guar gum (FCGG)., It may be employed as solvent to evaluate the dynamic nuclear polarization (DNP) parameters for the solutions of free radicals Galvinoxyl (GALV) and α,γ-bisdiphenylene-β-phenyl allyl complex with benzene (1:1) (BDPA).

Synthesis Reference(s)

Journal of the American Chemical Society, 77, p. 910, 1955 DOI: 10.1021/ja01609a033

Synthesis

5 g of C7H14O4 and 300 g of methanol were placed in a high-pressure vessel and degassed, followed by the addition of 300 g of hexafluoropropene, and the reaction was carried out by adding nitrogen to bring the pressure in the high-pressure vessel up to 300 psi. 20 minutes later, the temperature was heated to 40??C, and the reaction was maintained at this temperature for 24 hours, at which time the pressure was monitored, and the pressure was replenished with nitrogen to 300 psi when the pressure dropped below 250 psi during the reaction. When the pressure dropped below 250 psi during the reaction, it was replenished with nitrogen to 300 psi. the product solution was removed from the reaction and distilled, and 98 grams of the evaporated product were collected.

2,2,3,4,4,4-HEXAFLUORO-1-BUTANOL(382-31-0)Related Product Information

• N-BUTYL HEPTAFLUOROBUTYRATE
• ETHYL HEPTAFLUOROBUTYRATE
• SODIUM HEPTAFLUOROBUTYRATE
• SILVER HEPTAFLUOROBUTYRATE
• 3,3,4,4,5,5,5-HEPTAFLUORO-2-PENTANOL
• EUROPIUM-FOD-D9
• Heptafluorobutyric anhydride
• Heptafluorobutyric acid
• 2,2,3,4,4,4-HEXAFLUORO-1-BUTANOL
• HEPTAFLUOROBUTYRALDEHYDE HYDRATE, TECH.
• 1H,1H-HEPTAFLUOROBUTYL METHACRYLATE
• 2,2,3,4,4,4-Hexafluorobutyl acrylate
• 2,2,3,4,4,4-Hexafluorobutyl methacrylate
• 1H,1H-HEPTAFLUOROBUTYL ACRYLATE
• 2,2,3,3,4,4,4-Heptafluoro-1-butanol
• METHYL HEPTAFLUOROBUTYRATE
• tris[6,6,7,7,8,8,8-heptafluoro-2,2-di[(2H3)methyl](1,1,1-2H3)octane-3,5-dionato-O,O']praseodymium
• 1,1,1,3,3,3-HEXAFLUORO-TERT-BUTANOL,Hexafluoro-tert-butanol