ChemicalBook > CAS DataBase List > Hexafluoroacetone trihydrate

Hexafluoroacetone trihydrate

Product Name
Hexafluoroacetone trihydrate
CAS No.
34202-69-2
Chemical Name
Hexafluoroacetone trihydrate
Synonyms
HEXAFLUOROACETONE HYDRATE;gc7787;HFA·3H2O;Hexafluoroacet;uoroacetone trihydrate;Protirelin Impurity 12;Perfluoroacetone hydrate;PERFLUOROACETONE TRIHYDRATE;hexafluoro-acetontrihydrate;Hexafluoracetone trihydrate
CBNumber
CB2264341
Molecular Formula
C3H6F6O4
Formula Weight
220.07
MOL File
34202-69-2.mol
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Hexafluoroacetone trihydrate Property

Melting point:
18-21 °C(lit.)
Boiling point:
106-108 °C
Density 
1.579 g/mL at 25 °C(lit.)
vapor pressure 
87.5 psi ( 21 °C)
refractive index 
n20/D 1.319(lit.)
Flash point:
105-106°C
Water Solubility 
Completely soluble in water
form 
liquid
Specific Gravity
1.579
color 
colorless
Merck 
14,4685
BRN 
607236
InChI
InChI=1S/C3F6O.3H2O/c4-2(5,6)1(10)3(7,8)9;;;/h;3*1H2
InChIKey
SNZAEUWCEHDROX-UHFFFAOYSA-N
SMILES
C(F)(F)(F)C(=O)C(F)(F)F.O.O.O
CAS DataBase Reference
34202-69-2(CAS DataBase Reference)
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Safety

Hazard Codes 
T
Risk Statements 
23/24/25-34-63
Safety Statements 
26-36/37/39-45
RIDADR 
UN 2552 6.1/PG 2
WGK Germany 
3
RTECS 
UC2700000
Hazard Note 
Highly Toxic
TSCA 
Yes
HazardClass 
6.1
PackingGroup 
II
HS Code 
2914790090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H310Fatal in contact with skin

H314Causes severe skin burns and eye damage

H361Suspected of damaging fertility or the unborn child

Precautionary statements

P202Do not handle until all safety precautions have been read and understood.

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
139238
Product name
Hexafluoroacetone trihydrate
Purity
98%
Packaging
5g
Price
$26.6
Updated
2024/03/01
Sigma-Aldrich
Product number
139238
Product name
Hexafluoroacetone trihydrate
Purity
98%
Packaging
25g
Price
$102
Updated
2024/03/01
TCI Chemical
Product number
H0425
Product name
Hexafluoroacetone Hydrate
Purity
>97.0%(T)
Packaging
5g
Price
$23
Updated
2023/06/20
TCI Chemical
Product number
H0425
Product name
Hexafluoroacetone Hydrate
Purity
>97.0%(T)
Packaging
25g
Price
$46
Updated
2023/06/20
Alfa Aesar
Product number
L10777
Product name
Hexafluoroacetone trihydrate, 98%
Packaging
5g
Price
$31.65
Updated
2024/03/01
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Hexafluoroacetone trihydrate Chemical Properties,Usage,Production

Description

Hexafluoroacetone trihydrate, also known as gem diol, hexafluoropropan-2,2- diol, is a covalent hydrate of the ketone. It could used as a structure stabilizer for peptides. It was a metabolite of aerosol propellant HFA-227 and is present in the urine. It was shown to undergo an efficient carbonyl-ene reaction with a variety of alkenes in the presence of molecular sieves under microwave heating and conventional heating producing hexafluoroisopropanol functionalized derivatives in high yields[1-2].

Uses

Hexafluoroacetone trihydrate (HFA?3H2O) is used to produce Sevoflurane,a high quality anesthetic and Bisphenol AF, a crosslinker for fluoroelastomers. It can also be used to produce various high-end fluorinated products such as fluorinated polyimide, etc.

Uses

Hexafluoroacetone trihydrate was used to study the kinetics and thermodynamics of linkage isomerization of (acetone)pentaammineruthenium (III) and-ruthenium (II) complexes. It was used in a study to reconstitute the α-and β-polypeptides of both Rhodobacter sphaeroides and Rhodospirillum rubrum with bacteriochlorophyll a.

General Description

Hexafluoroacetone trihydrate forms crystalline 1:1 complexes with imidazole 3-oxides.

Synthesis

A spherical fluorinated alumina catalyst (30 g) (particle diameter: 2 to 4 mm) was charged into a reaction tube made of SUS316 (inner diameter: 16 mm, length: 460 mm). The reaction tube was heated to 140° C, and hexafluoro-1,2-epoxypropane (purity: 95%, impurity content: 5% hexafluoropropene) was fed into the reaction tube under the conditions of a feed rate of 50 Nml/min and a total pressure of 3 atmospheres. After 1 hour, the exit gas was analyzed by gas chromatography, with the result that the conversion of hexafluoro-1,2-epoxypropane was 100%. The exit gas was passed into the water, producing crude hexafluoroacetone trihydrate.

References

[1] Sridhar M, et al. A facile method for the preparation of hexafluoroisopropanol functionalized derivatives using hexafluoroacetone trihydrate via a carbonyl-ene reaction. Tetrahedron Letters, 2009; 50: 1777-1779.
[2] K?ster U, et al. Biotransformation of the aerosol propellant 1,1,1,2,3,3,3-heptafluoropropane (HFA-227): lack of protein binding of the metabolite hexafluoroacetone. Drug Metabolism and Disposition , 1996.

Hexafluoroacetone trihydrate Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from Hexafluoroacetone trihydrate manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
Hexafluoroacetone trihydrate 34202-69-2
Price
US $1.00/Kg
Min. Order
1Kg
Purity
98%
Supply Ability
20T
Release date
2024-08-09
Shaanxi Dideu Medichem Co. Ltd
Product
Hexafluoroacetone trihydrate 34202-69-2
Price
US $996.00/KG
Min. Order
1KG
Purity
98.0%
Supply Ability
1T
Release date
2020-07-06
Hebei Weibang Biotechnology Co., Ltd
Product
Hexafluoroacetone trihydrate 34202-69-2
Price
US $0.00-0.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20 mt
Release date
2023-02-16

34202-69-2, Hexafluoroacetone trihydrateRelated Search:


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  • Organic Building Blocks
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