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Tert-butyl 2,2-dioxooxathiazinane-3-carboxylate, also known as tert-butyl 4-oxo-1,3,2-dioxathiazinane-3-carboxylate, is a chemical compound belonging to the oxathiazinane family. It has the molecular formula C9H13NO5S and is characterized by a six-membered ring containing oxygen, sulfur, and nitrogen atoms. tert-butyl 2,2-dioxooxathiazinane-3-carboxylate is recognized for its unique ring structure and functional groups, making it a versatile building block in organic synthesis and pharmaceutical research. Due to its potential health and environmental hazards, it is crucial to handle tert-butyl 2,2-dioxooxathiazinane-3-carboxylate with care.

521267-18-5

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521267-18-5 Usage

Uses

Used in Organic Synthesis:
Tert-butyl 2,2-dioxooxathiazinane-3-carboxylate is used as a reagent in organic synthesis for its unique ring structure and functional groups, which allow for the preparation of various organic compounds.
Used in Pharmaceutical Research:
In the pharmaceutical industry, tert-butyl 2,2-dioxooxathiazinane-3-carboxylate is utilized as a building block for the development of new pharmaceuticals, owing to its versatile chemical properties and potential applications in drug discovery and design.

Check Digit Verification of cas no

The CAS Registry Mumber 521267-18-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 5,2,1,2,6 and 7 respectively; the second part has 2 digits, 1 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 521267-18:
(8*5)+(7*2)+(6*1)+(5*2)+(4*6)+(3*7)+(2*1)+(1*8)=125
125 % 10 = 5
So 521267-18-5 is a valid CAS Registry Number.

521267-18-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name tert butyl 1,2,3-oxathiazinane-3-carboxylate 2,2-dioxide

1.2 Other means of identification

Product number -
Other names tert-butyl 2,2-dioxo-1,2,3-oxathiazinane-3-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:521267-18-5 SDS

521267-18-5Relevant academic research and scientific papers

Nucleophilic Trifluoromethylthiolation of Cyclic Sulfamidates: Access to Chiral β- And γ-SCF3 Amines and α-Amino Esters

Zeng, Jun-Liang,Chachignon, Hélène,Ma, Jun-An,Cahard, Dominique

, p. 1974 - 1977 (2017/04/27)

The regio- and stereoselective ring opening of 1,2- and 1,3-sulfamidates with trifluoromethanethiolate anion is reported. This direct introduction of the whole SCF3 motif is a straightforward synthetic route toward β- and γ-SCF3 amines and α-amino acid derivatives. The utility of this reaction was further illustrated by incorporation of Cys(S-CF3) into di- and tripeptides.

Modular, gold-catalyzed approach to the synthesis of lead-like piperazine scaffolds

James, Thomas,Simpson, Iain,Grant, J. Andrew,Sridharan, Visuvanathar,Nelson, Adam

supporting information, p. 6094 - 6097 (2014/01/06)

Ring-opening of cyclic sulfamidates with propargylic sulfonamides yielded substrates for a gold-catalyzed cyclization to yield tetrahydropyrazines. Manipulation of the tetrahydropyrazines, by reduction or using multicomponent reactions, yielded piperazine scaffolds in which substitution of the carbon atoms was varied. Such scaffolds may have value in the synthesis of novel screening compounds with lead-like molecular properties.

Catalytic asymmetric alkylation reactions for the construction of protected ethylene-amino and propylene-amino motifs attached to quaternary stereocentres

Moss, Thomas A.,Barber, David M.,Kyle, Andrew F.,Dixon, Darren J.

, p. 3071 - 3081 (2013/03/28)

An efficient catalytic and stereoselective method for the direct construction of protected ethylene-amino and propylene-amino scaffolds attached to quaternary stereocentres is reported. Preliminary investigations revealed a mild base catalysed nucleophilic ring opening of N-sulfonyl aziridines using the commercially available phosphazene base 2-tert-butylimino-2-diethylamino-1,3- dimethyl-perhydro-1,3,2-diazaphosphorine (BEMP) was possible and resulted in highly efficient alkylation reactions with a range of methine carbon acids. This reaction could be rendered highly asymmetric (up to 97 % ee) by employing phase-transfer catalysis to control stereoinduction. Incorporation of alkyl substituents onto the aziridine electrophile, resulted in a highly diastereoselective (up to 30:1 d.r.) variant of this methodology. A further extension using N-protected cyclic sulfamidates as the electrophilic component was successful with a range of pro-nucleophiles (up to 96 % ee and 45:1 d.r.) and allowed a range of nitrogen protecting groups (carbamate, sulfonyl, phosphonyl, benzyl) to be incorporated into the alkylation adducts. Finally, the utility of the products have been demonstrated in the synthesis of useful heterocycles and compounds bearing structural components of natural products. Open sesame: The enantio- and diastereoselective nucleophilic ring opening of protected aziridines and cyclic sulfamidates using asymmetric phase-transfer catalysis (PTC) is reported. The ring-opening alkylation reactions create quaternary chiral centres containing ethylene- and propylene-amino motifs in good yields with good to excellent enantioselectivities (see scheme). These reactions are broad in scope and a wide range of pro-nucleophiles are tolerated. Copyright

Catalytic enantio- and diastereoselective alkylations with cyclic sulfamidates

Moss, Thomas A.,Alonso, Beatriz,Fenwick, David R.,Dixon, Darren J.

supporting information; experimental part, p. 568 - 571 (2010/04/05)

(Figure Presented) Open for business: The enantio- and diastereoselective nucleophilic ring opening of five-membered and six-membered cyclic sulfamidates under asymmetric phase-transfer catalysis is presented. A range of pro-nucleophiles have been successfully alkylated in good yields and in good to excellent enantioselectivites.

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