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ETHYL 2-(TRIFLUOROMETHYL SULFONYLOXY)-1-CYCLOHEXENE-1-CARBOXYLATE is a chemical compound that serves as a valuable building block in the field of organic synthesis. Its unique structure and functional groups make it a versatile component for creating a wide range of organic molecules.

122135-83-5

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122135-83-5 Usage

Uses

Used in Organic Synthesis:
ETHYL 2-(TRIFLUOROMETHYL SULFONYLOXY)-1-CYCLOHEXENE-1-CARBOXYLATE is used as a building block in organic synthesis for its ability to contribute to the formation of complex organic molecules. Its trifluoromethyl sulfonyloxy group and cyclohexene carboxylate moiety provide opportunities for various chemical reactions, enabling the synthesis of a diverse array of compounds with potential applications in different industries.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, ETHYL 2-(TRIFLUOROMETHYL SULFONYLOXY)-1-CYCLOHEXENE-1-CARBOXYLATE is used as a key intermediate in the synthesis of drug molecules. Its unique functional groups can be utilized to create novel pharmaceutical compounds with potential therapeutic properties, contributing to the development of new treatments for various diseases and medical conditions.
Used in Agrochemical Industry:
ETHYL 2-(TRIFLUOROMETHYL SULFONYLOXY)-1-CYCLOHEXENE-1-CARBOXYLATE is also used in the agrochemical industry as a precursor for the development of new pesticides and herbicides. Its chemical properties allow for the creation of compounds with effective pesticidal or herbicidal activity, helping to improve crop protection and yield.
Used in Material Science:
In the field of material science, ETHYL 2-(TRIFLUOROMETHYL SULFONYLOXY)-1-CYCLOHEXENE-1-CARBOXYLATE is used as a component in the synthesis of advanced materials. Its incorporation into polymers and other materials can lead to the development of new materials with improved properties, such as enhanced stability, durability, or specific functional characteristics.

Check Digit Verification of cas no

The CAS Registry Mumber 122135-83-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,2,1,3 and 5 respectively; the second part has 2 digits, 8 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 122135-83:
(8*1)+(7*2)+(6*2)+(5*1)+(4*3)+(3*5)+(2*8)+(1*3)=85
85 % 10 = 5
So 122135-83-5 is a valid CAS Registry Number.
InChI:InChI=1/C10H13F3O5S/c1-2-17-9(14)7-5-3-4-6-8(7)18-19(15,16)10(11,12)13/h2-6H2,1H3

122135-83-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 2-(trifluoromethylsulfonyloxy)cyclohexene-1-carboxylate

1.2 Other means of identification

Product number -
Other names Ethyl 2-(trifluoromethyl sulfonyloxy)-1-cyclohenxene-1-carboxylate

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:122135-83-5 SDS

122135-83-5Relevant academic research and scientific papers

Iodane-Guided ortho C?H Allylation

Chen, Dandan,Chen, Wei W.,Cuenca, Ana B.,Cunillera, Anton,López de Moragas, Albert,Lethu, Sébastien,Shafir, Alexandr,Solà, Miquel,Zhu, Jun

, p. 20201 - 20207 (2020)

A metal-free C?H allylation strategy is described to access diverse functionalized ortho-allyl-iodoarenes. The method employs hypervalent (diacetoxy)iodoarenes and proceeds through the iodane-guided “iodonio-Claisen” allyl transfer. The use of allylsilanes bearing electron-withdrawing functional groups unlocks the functionalization of a broad range of substrates, including electron-neutral and electron-poor rings. The resulting ortho-allylated iodoarenes are versatile building blocks, with examples of downstream transformation including a concise synthesis of the experimental antimitotic core of Dosabulin. DFT calculations shed additional light on the reaction mechanism, with notable aspects including the aromatic character of the transition-state structure for the [3,3] sigmatropic rearrangement, as well as the highly stereoconvergent nature of the trans-product formation.

Cut and sew: Benzofuran-ring-opening enabled cyclopentenone ring formation

Wang, Kai,Jiang, Chenghao,Zhang, Zhenming,Han, Chunyu,Wang, Xuewei,Li, Yaping,Chen, Kaiting,Zhao, Junfeng

, p. 12817 - 12820 (2020)

A facile approach to the fully substituted cyclopentenones involving an unprecedented benzofuran-ring-opening is described. The cleavage of a benzofuran endocyclic C2-O bond proceeded smoothly in the absence of any transition metal catalyst or highly reactive organometallic reagent. Such benzofuran-ring-opening is delicately incorporated into an acid-catalyzed cascade process, orchestrating a novel synthetic strategy for complex cyclopentenones with excellent yields and diastereoselectivities. This journal is

Intermolecular copper(I) chloride-mediated coupling of alkenyltrialkylstannane functions: A convenient synthesis of conjugated diene systems

Piers, Edward,McEachern, Ernest J.,Romero, Miguel A.

, p. 1173 - 1176 (1996)

A novel copper(I)-mediated coupling of alkenyltrialkylstannane functions is reported. Thus, treatment of the functionalized stannanes 1-11 with 2,5 equivalents of CuCl in N,N-dimethylformamide (DMF) at room temperature provides good-to-excellent yields of

A convenient method for the synthesis of Δ1,6-bicyclo[4.n.0]alken-2-ones

Watanabe, Norihiko,Tanino, Keiji,Kuwajima, Isao

, p. 8133 - 8136 (1999)

A convenient annulation method for the synthesis of bicyclic enones from cycloalkanones was developed. In the presence of a Pd(0) catalyst, enol triflates derived from ethyl 2-oxocycloalkanecarboxylates were treated with 3-(ethoxycarbonyl)propylzinc iodid

Preparation method of sulfydryl alkenyl ester compound

-

Paragraph 0021-0024, (2021/07/21)

The invention relates to a preparation method of a sulfydryl alkenyl ester compound, belongs to the field of organic chemical synthesis, and aims to solve the problems of high risk of large-scale production and the like, and the synthesis route provided b

Preparation method 2 - (chlorosulfonyl) cyclohexane -1 - allyl formate derivative

-

Paragraph 0066-0069; 0074-0081; 0090-0092, (2021/11/14)

The invention relates to a preparation method of 2 - (chlorosulfonyl) cyclohexane -1 - allyl formate derivative, which comprises the following steps: 1) dissolving the compound of formula III in an organic solvent; and reacting the compound of formula IV

Enantioselective Synthesis of γ-Functionalized Cyclopentenones and δ-Functionalized Cycloheptenones Utilizing a Redox-Relay Heck Strategy

Yuan, Qianjia,Prater, Matthew B.,Sigman, Matthew S.

supporting information, p. 326 - 330 (2019/11/14)

In this report, the desymmetrization of cyclic enones under relay Heck conditions with an array of aryl boronic acids, alkenyl triflates and indole derivatives is described. This method grants facile access to diverse γ-functionalized cyclopentenones and δ-functionalized cycloheptenones. Using this approach, a formal synthesis of (S)-baclofen was completed in high yield and excellent enantioselectivity. (Figure presented.).

Mechanistic Divergence in the Hydrogenative Synthesis of Furans and Butenolides: Ruthenium Carbenes Formed by gem-Hydrogenation or through Carbophilic Activation of Alkynes

Peil, Sebastian,Fürstner, Alois

supporting information, p. 18476 - 18481 (2019/11/14)

Enynes with a tethered carbonyl substituent are converted into substituted furan derivatives upon hydrogenation using [Cp*RuCl]4 as the catalyst. Paradoxically, this transformation can occur along two distinct pathways, each of which proceeds via discrete pianostool ruthenium carbenes. In the first case, hydrogenation and carbene formation are synchronized (“gem-hydrogenation”), whereas the second pathway comprises carbene formation by carbophilic activation of the triple bond, followed by hydrogenative catalyst recycling. Representative carbene intermediates of either route were characterized by X-ray crystallography; the structural data prove that the attack of the carbonyl group on the electrophilic carbene center follows a Bürgi–Dunitz trajectory.

Controlling the Selectivity Patterns of Au-Catalyzed Cyclization-Migration Reactions

Chen, Mo,Su, Naijing,Deng, Tianning,Wink, Donald J.,Zhao, Yingwei,Driver, Tom G.

supporting information, p. 1555 - 1558 (2019/03/20)

As little as 2 mol % of (XPhos)AuNTf2 catalyzes the transformation of a broad range of o-acetylene-substituted styrenes into 1,2-dihydronaphthalenes. Our data suggests that this transformation occurs via a gold-stabilized cyclopropyl carbinyl cation, which triggers either a [1,2] carboxylate shift or a less favorable [1,2] aryl shift. The relative rates of these migrations can be controlled by the identity of the ligand or by stabilizing the mesomeric cation.

PhI(OAc)2-mediated alkoxyoxygenation of β,γ-unsaturated ketoximes: Preparation of isoxazolines bearing two contiguous tetrasubstituted carbons

Ye, Chenghao,Kou, Xuezhen,Yang, Guoqiang,Shen, Jiefeng,Zhang, Wanbin

supporting information, p. 1148 - 1152 (2019/03/26)

A PhI(OAc)2-promoted dioxygenation of allyl oximes, including one alkoxylation, has been developed. This reaction can give isoxazoline products bearing two contiguous tetrasubstituted carbons. Various oximes substrates bearing different aryl groups and tetrasubstituted-olefin moieties were compatible with the mild reaction conditions. A two-electron oxidation pathway was proposed based on results of preliminary mechanistic studies.

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