1,1,1-Trifluoroacetylacetone

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Names

[ CAS No. ]:
367-57-7

[ Name ]:
1,1,1-Trifluoroacetylacetone

[Synonym ]:
2,4-Pentanedione, 1,1,1-trifluoro-
FXFFV1V1
α,α,α-Trifluoroacetylacetone
1,1,1-Trifluoroacetylacetone
1,1,1-trifluoropentane-2,4-dione
MFCD00000427
(Trifluoroacetyl)acetone
1,1,1-Trifluoro-2,4-pentanedione
Trifluoroacetylacetone
Palladium(II)trifluoro-2,4-pentanedionate
EINECS 206-698-5

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
106.0±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C₅H₅F₃O₂

[ Molecular Weight ]:
154.087

[ Flash Point ]:
26.1±0.0 °C

[ Exact Mass ]:
154.024170

[ PSA ]:
34.14000

[ LogP ]:
2.09

[ Vapour Pressure ]:
28.8±0.2 mmHg at 25°C

[ Index of Refraction ]:
1.343

[ Storage condition ]:
Flammables area

[ Water Solubility ]:
slightly soluble

MSDS

Click to get detail MSDS

Safety Information

[ Symbol ]:

GHS02, GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226-H302 + H312 + H332

[ Precautionary Statements ]:
P280

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R10;R20/21/22;R36/37/38

[ Safety Phrases ]:
S36/37-S36/37/39-S26-S16

[ RIDADR ]:
UN 1224 3/PG 3

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
29147090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

DownStream

5,5,5-trifluoro-4-hydroxyiminopentan-2-one
Ethyl trifluoroacetate
Acetone
2-bromo-6-methyl-4-trifluoromethylpyridine
1-(4-METHOXYPHENYL)-5-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE
1-(4-METHOXYPHENYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
7-[[(4-FLUOROPHENYL)METHYL]AMINO]-8-METHYLNONAN-1-OICACID
2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
2-MERCAPTO-6-METHYL-4-(TRIFLUOROMETHYL)NICOTINONITRILE

Customs

[ HS Code ]: 2914700090

[ Summary ]:
HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

Articles

Inhibition by diacylmethane derivatives of mutagenicity in Salmonella typhimurium and tRNA-binding of chemical carcinogens.

Mutat. Res. 262(3) , 189-93, (1991)

Effects of diacylmethanes on the mutagenicity of 2-naphthohydroxamic acid, methylnitrosourea, benzo[a]pyrene and aflatoxin B1 in S. typhimurium and the tRNA binding by benzo[a]pyrene and aflatoxin B1 ...

Inhibition by diacylmethane derivatives of mutagenicity and nucleic acid binding of 2-aminofluorene derivatives.

J. Natl. Cancer Inst. 81(22) , 1743-7, (1989)

The active methylene compounds acetylacetone, 1,1,1-trifluoroacetylacetone, benzoylacetone, dibenzoylmethane, and 1,3-indandione inhibited the mutagenicity of 2-nitrofluorene in Salmonella typhimurium...

Synthesis and anticancer activity evaluation of new 2-alkylcarbonyl and 2-benzoyl-3-trifluoromethyl-quinoxaline 1,4-di-N-oxide derivatives.

Bioorg. Med. Chem. 12(13) , 3711-21, (2004)

As a continuation of our research in quinoxaline 1,4-di-N-oxide and with the aim of obtaining new anticancer agents, which can improve the current chemotherapeutic treatments, new series of 2-alkylcar...

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