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Acetic acid, 2,2,2-trifluoro-, 1-ethylbutyl ester, also known as 1-ethylbutyl 2,2,2-trifluoroacetate, is an organic compound with the chemical formula C7H13F3O2. It is a colorless liquid with a molecular weight of 192.17 g/mol. This ester is formed by the reaction of 2,2,2-trifluoroacetic acid with 1-ethylbutanol, resulting in a compound that possesses a unique combination of properties. It is characterized by its low boiling point, high reactivity, and the presence of a trifluoromethyl group, which imparts specific chemical reactivity and stability. This ester has potential applications in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals, where its unique properties can be exploited for specific reactions or as a solvent.

761-34-2

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761-34-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 761-34-2 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 7,6 and 1 respectively; the second part has 2 digits, 3 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 761-34:
(5*7)+(4*6)+(3*1)+(2*3)+(1*4)=72
72 % 10 = 2
So 761-34-2 is a valid CAS Registry Number.
InChI:InChI=1/C8H13F3O2/c1-3-5-6(4-2)13-7(12)8(9,10)11/h6H,3-5H2,1-2H3

761-34-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name hexan-3-yl 2,2,2-trifluoroacetate

1.2 Other means of identification

Product number -
Other names 3-Hexyltrifluoroacetate

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:761-34-2 SDS

761-34-2Downstream Products

761-34-2Relevant academic research and scientific papers

Aerobic Partial Oxidation of Alkanes Using Photodriven Iron Catalysis

Coutard, Nathan,Goldberg, Jonathan M.,Valle, Henry U.,Cao, Yuan,Jia, Xiaofan,Jeffrey, Philip D.,Gunnoe, T. Brent,Groves, John T.

supporting information, p. 759 - 766 (2022/01/11)

Photodriven oxidations of alkanes in trifluoroacetic acid using commercial and synthesized Fe(III) sources as catalyst precursors and dioxygen (O2) as the terminal oxidant are reported. The reactions produce alkyl esters and occur at ambient temperature in the presence of air, and catalytic turnover is observed for the oxidation of methane in a pure O2 atmosphere. Under optimized conditions, approximately 17% conversion of methane to methyl trifluoroacetate at more than 50% selectivity is observed. It is demonstrated that methyl trifluoroacetate is stable under catalytic conditions, and thus overoxidized products are not formed through secondary oxidation of methyl trifluoroacetate.

Ruthenium-catalysed oxidation of alkanes with peracetic acid in trifluoroacetic acid: Ruthenium as an efficient catalyst for the oxidation of unactivated C-H bonds

Komiya,Noji,Murahashi

, p. 65 - 66 (2007/10/03)

The role of ruthenium catalysts for the oxidation of alkanes with peracetic acid in trifluoroacetic acid has been confirmed.

Observations on the transition-metal catalysed oxidation of alkanes in trifluoroacetic acid: Urea-hydrogen peroxide/TFA as a convenient method for the oxidation of unactivated C-H bonds

Moody, Christopher J.,O'Connell, Jenny L.

, p. 1311 - 1312 (2007/10/03)

Oxidation of cyclohexane in TFA using 30% aqueous H2O2 or urea-H2O2 (UHP) gives cyclohexyl trifluoroacetate in good yield, although the reaction is not accelerated by rhodium or ruthenium catalysts casting doubt

Eine allgemeine und effiziente Methode zur Monohydroxylierung von Alkanen

Asensio, Gregorio,Mello, Rossella,Gonzalez-Nunez, Maria Elena,Castellano, Gloria,Corral, Julia

, p. 196 - 198 (2007/10/03)

Keywords: Alkane; Dioxirane; Hydroxylierungen; Oxidationen

Selective Markovnikov's Addition of Trifluoroacetic Acid to Alkenes using Vanadium(v) Oxide

Choudary, B. M.,Reddy, P. N.

, p. 405 - 407 (2007/10/02)

A simple and efficient method for trifluoroacetoxylation of alkenes using catalytic amounts of V2O5 in trifluoroacetic acid to give the Markovnikov's product selectively in excellent yields for the first time is described.

SELECTIVE OXIDATION OF n-ALKANES WITH LEAD TETRAACETATE

Bestre, R. D.,Cole, E. R.,Crank, G.

, p. 3891 - 3892 (2007/10/02)

Alkanes, when treated with lead tetraacetate under thermal or photochemical conditions, undergo a slow but highly selective oxidation to form secondary acetates.

Enthalpies of Hydration of Alkenes. 1. The n-Hexenes

Wiberg, Kenneth B.,Wasserman, David J.

, p. 6563 - 6566 (2007/10/02)

Alkenes undergo a rapid reaction with trifluoroacetic acid containing 0.25 M trifluoroacetic anhydride in the presence of a strong acid catalyst.The enthalpies of trifluoroacetolysis of the five n-hexenes were determined and were corrected to the enthalpies corresponding to the formation of the equilibrium mixture of 2-hexyl trifluoroacetate and 3-hexyl trifluoroacetate.The enthalpy difference between the latter was determined by measuring the equilibrium constant as a function of temperature.The trifluoroacetolysis data may be combined with the measured enthalpies of formation of the alkenes to derive more precise values for the latter.The enthalpies of reaction of water, 2-hexanol, and 3-hexanol with the reaction solvent were determined, and when combined with the other data lead to enthalpies of hydration of the alkenes and the enthalpies of formation of the alcohols.

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