1,1,1-Trifluoro-2,4-pentanedione

Base Information

Chemical Name:1,1,1-Trifluoro-2,4-pentanedione
CAS No.:367-57-7
Molecular Formula:C5H5F3O2
Molecular Weight:154.089
Hs Code.:29147090
European Community (EC) Number:206-698-5
NSC Number:9455
UNII:9N20A8G8SW
DSSTox Substance ID:DTXSID3059896
Nikkaji Number:J142.987F
Wikipedia:1,1,1-Trifluoroacetylacetone
Wikidata:Q27272769
ChEMBL ID:CHEMBL106855
Mol file:367-57-7.mol

Synonyms:1,1,1-TFAA;1,1,1-trifluoroacetylacetone

Suppliers and Price of 1,1,1-Trifluoro-2,4-pentanedione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TCI Chemical
Trifluoroacetylacetone >98.0%(GC)
100g
$ 228.00

TCI Chemical
Trifluoroacetylacetone >98.0%(GC)
25g
$ 78.00

SynQuest Laboratories
1,1,1-Trifluoropentane-2,4-dione 98%
5 g
$ 15.00

SynQuest Laboratories
1,1,1-Trifluoropentane-2,4-dione 98%
2 g
$ 10.00

SynQuest Laboratories
1,1,1-Trifluoropentane-2,4-dione 98%
25 g
$ 55.00

SynQuest Laboratories
1,1,1-Trifluoropentane-2,4-dione 98%
100 g
$ 95.00

Strem Chemicals
1,1,1-Trifluoroacetylacetone, min. 98%
50g
$ 198.00

Strem Chemicals
1,1,1-Trifluoroacetylacetone, min. 98%
10g
$ 52.00

Sigma-Aldrich
1,1,1-Trifluoro-2,4-pentanedione 98%
10g
$ 42.70

Sigma-Aldrich
1,1,1-Trifluoro-2,4-pentanedione 98%
25g
$ 84.90

Total 89 raw suppliers

Chemical Property of 1,1,1-Trifluoro-2,4-pentanedione

Chemical Property:

Appearance/Colour:Clear light yellow to orange liquid
Vapor Pressure:36.3mmHg at 25°C
Refractive Index:n20/D 1.388(lit.)
Boiling Point:106 °C at 760 mmHg
PKA:6.69±0.10(Predicted)
Flash Point:26.1 °C
PSA：34.14000
Density:1.266 g/cm³
LogP:1.09690
Storage Temp.:Flammables area
Water Solubility.:slightly soluble
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:154.02416388
Heavy Atom Count:10
Complexity:159

Purity/Quality:

99%, ^*data from raw suppliers

Trifluoroacetylacetone >98.0%(GC) ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn; F; Xi
Hazard Codes:Xn,F,Xi
Statements: 10-20/21/22-36/37/38
Safety Statements: 36/37-36/37/39-26-16

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Chemical Classes:Other Classes -> Halogenated Ketones
Canonical SMILES:CC(=O)CC(=O)C(F)(F)F
Uses 1,1,1-Trifluoro-2,4-pentanedione has been used as reagent in the preparation of 2-alkylcarbonyl and 2-benzoyl-3-trifluoromethylquinoxaline 1,4-di-N-oxide derivatives.

Technology Process of 1,1,1-Trifluoro-2,4-pentanedione

There total 16 articles about 1,1,1-Trifluoro-2,4-pentanedione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 99.0%

: 4-[(2-Methoxyphenyl)imino]-1,1,1-trifluoro-2-pentanone

: 367-57-7
1,1,1-Trifluoro-2,4-pentanedione

Guidance literature:

Reference yield: 53.3%

: 67-64-1
acetone

: 658-78-6
1-nitro-4-trifluoroacetoxy-benzene

: 367-57-7
1,1,1-Trifluoro-2,4-pentanedione

Guidance literature:: acetone; 1-nitro-4-trifluoroacetoxy-benzene; With sodium ethanolate; In toluene; at 20 ℃; for 6h;

With sulfuric acid;

Reference yield: 50.3%

: 5672-87-7
p-methoxyphenyl trifluoroacetate

: 67-64-1
acetone

: 367-57-7
1,1,1-Trifluoro-2,4-pentanedione

Guidance literature:: p-methoxyphenyl trifluoroacetate; acetone; With sodium ethanolate; In toluene; at 60 ℃; for 1h;

With sulfuric acid;