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1,1,1-Trifluoro-2-hexanone is a synthetic organic compound with the chemical formula C6H9F3O. It is a colorless liquid with a pungent odor and is soluble in organic solvents. 1,1,1-Trifluoro-2-hexanone is primarily used as a building block in the synthesis of various pharmaceuticals, agrochemicals, and other specialty chemicals. It is also known for its potential use as a solvent and as a reagent in chemical reactions. Due to its reactivity and the presence of fluorine atoms, 1,1,1-trifluoro-2-hexanone can participate in a range of chemical transformations, making it a valuable intermediate in the chemical industry.

360-34-9

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360-34-9 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 360-34-9 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 3,6 and 0 respectively; the second part has 2 digits, 3 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 360-34:
(5*3)+(4*6)+(3*0)+(2*3)+(1*4)=49
49 % 10 = 9
So 360-34-9 is a valid CAS Registry Number.
InChI:InChI=1/C6H9F3O/c1-2-3-4-5(10)6(7,8)9/h2-4H2,1H3

360-34-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,1,1-trifluorohexan-2-one

1.2 Other means of identification

Product number -
Other names n-butyl trifluoromethyl cetone

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:360-34-9 SDS

360-34-9Relevant academic research and scientific papers

Highly selective trifluoroacetic ester/ketone metathesis: An efficient approach to trifluoromethyl ketones and esters

Zhou, Yuhan,Yang, Dongmei,Luo, Gen,Zhao, Yilong,Luo, Yi,Xue, Na,Qu, Jingping

, p. 4668 - 4674 (2014/06/23)

A highly selective and atom efficient 'trifluoroacetic ester/ketone metathesis' has been sincerely witnessed. Enolizable alkyl (at least two non-hydrogen atoms) aryl ketones were found to react readily with ethyl trifluoroacetate under the promotion of NaH to afford trifluoroacetic ester/ketone exchange products, trifluoromethyl ketones (TFMKs), and aromatic acid esters, which were quite different from the general Claisen condensation products, 1,3-diketones. The outcome of the reaction between ketone and ethyl trifluoroacetate is strongly related to the structures of substrates, the steric congestion caused by alkyl group is in favor of the C-C bond cleavage. DFT investigation further disclosed that the metathesis reaction was a kinetically favored pathway. Using only a slight excess of cheap trifluoromethylation reagent, simple operation and mild conditions make it a practical method for preparation of TFMKs on large scale, as well as a new choice of converting aryl alkyl ketones to aromatic acid esters.

Synthesis of trifluoromethyl ketones via tandem Claisen condensation and retro-Claisen C-C bond-cleavage reaction

Yang, Dongmei,Zhou, Yuhan,Xue, Na,Qu, Jingping

, p. 4171 - 4176 (2013/06/05)

A highly efficient, operationally simple approach to trifluoromethyl ketones has been developed that builds on the use of a tandem process involving Claisen condensation and retro-Claisen C-C bond cleavage reaction. Enolizable alkyl phenyl ketones were found to react readily with ethyl trifuoroacetate under the promotion of NaH to afford trifluoroacetic ester/ketone exchange products, trifluoromethyl ketones, which were quite different from the general Claisen condensation products, β-diketones. This procedure uses readily available starting materials and can be extended to the preparation of perfluoroalkyl ketones in excellent yield.

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