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N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide is a sulfonamide derivative, a chemical compound characterized by the presence of a sulfonyl group attached to an amine group. It is known for its ability to inhibit the activity of certain enzymes involved in the production of prostaglandins, which are key mediators of inflammation and pain.

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  • 58754-95-3 Structure
  • Basic information

    1. Product Name: N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide
    2. Synonyms: N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide
    3. CAS NO:58754-95-3
    4. Molecular Formula: C11H17NO4S
    5. Molecular Weight: 259.324
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 58754-95-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide(CAS DataBase Reference)
    10. NIST Chemistry Reference: N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide(58754-95-3)
    11. EPA Substance Registry System: N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide(58754-95-3)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 58754-95-3(Hazardous Substances Data)

58754-95-3 Usage

Uses

Used in Pharmaceutical Applications:
N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide is used as an anti-inflammatory and analgesic agent for the treatment of conditions such as rheumatoid arthritis and other inflammatory disorders. Its chemical structure, featuring a substituted benzene ring and a dimethoxyethyl group, enables interactions with specific receptor sites in the body, contributing to its therapeutic effects.
Used in Research Applications:
N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide also serves as a research chemical, facilitating the study of enzyme inhibition mechanisms and their implications in various biological processes and disease states.
Used in Organic Synthesis:
Furthermore, N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide is utilized as a reagent in organic synthesis, playing a role in the development of new chemical entities and the synthesis of complex organic molecules.

Check Digit Verification of cas no

The CAS Registry Mumber 58754-95-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,8,7,5 and 4 respectively; the second part has 2 digits, 9 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 58754-95:
(7*5)+(6*8)+(5*7)+(4*5)+(3*4)+(2*9)+(1*5)=173
173 % 10 = 3
So 58754-95-3 is a valid CAS Registry Number.

58754-95-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name N-(2,2-Dimethoxyethyl)-4-methylbenzenesulfonamide

1.2 Other means of identification

Product number -
Other names UPCMLD00WCRH3-053

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:58754-95-3 SDS

58754-95-3Relevant articles and documents

Iron-Catalyzed Diastereoselective Synthesis of Disubstituted Morpholines via C-O or C-N Bond Formation

Aubineau, Thomas,Dupas, Alexandre,Zeng, Tian,Cossy, Janine

supporting information, p. 525 - 531 (2020/08/28)

The diastereoselective synthesis of 2,6- and 3,5-disubstituted morpholines was achieved from 1,2-amino ethers and 1,2-hydroxy amines substituted by an allylic alcohol using an iron(III) catalyst. The morpholines were obtained either by C-O or C-N bond formation. A plausible mechanism is suggested, involving a thermodynamic equilibrium to explain the formation of the cis diastereoisomer as the major product.

Iron-catalyzed alkyne-carbonyl metathesis for the synthesis of 6,7-dihydro-5H-dibenzo[c,e]azonines

Chakraborty, Baitan,Jana, Umasish

supporting information, p. 10549 - 10553 (2021/12/27)

The synthesis of nine-membered ringsviaalkyne-carbonyl metathesis is reported. The alkyne and acetal units contained in a biaryl substrate undergo the intramolecular alkyne-carbonyl metathesis reaction under FeCl3-catalysis to furnish the unexp

Copper-catalyzed cycloisomerization of unactivated allene-tethered O-propargyl oximes: A domino reaction sequence toward the synthesis of hexahydropyrrolo[3,4- b]azepin-5(4 H)-ones

Nikbakht, Ali,Amiri, Kamran,Khosravi, Hormoz,Zhou, Yirong,Balalaie, Saeed,Breit, Bernhard

supporting information, p. 3343 - 3348 (2021/05/07)

A novel copper-catalyzed cycloisomerization of unactivated allene-tethered O-propargyl oximes has been developed for the synthesis of hexahydropyrrolo[3,4-b]azepin-5(4H)-ones. This one-pot domino reaction proceeds via a [2,3]-sigmatropic rearrangement, a

Palladium-Catalyzed C(sp3)?H Arylation of Primary Amines Using a Catalytic Alkyl Acetal to Form a Transient Directing Group

St John-Campbell, Sahra,Ou, Alex K.,Bull, James A.

supporting information, p. 17838 - 17843 (2018/11/23)

C?H Functionalization of amines is a prominent challenge due to the strong complexation of amines to transition metal catalysts, and therefore typically requires derivatization at nitrogen with a directing group. Transient directing groups (TDGs) permit C?H functionalization in a single operation, without needing these additional steps for directing group installation and removal. Here we report a palladium catalyzed γ-C?H arylation of amines using catalytic amounts of alkyl acetals as transient activators (e.g. commercially available (2,2-dimethoxyethoxy)benzene). This simple additive enables arylation of amines with a wide range of aryl iodides. Key structural features of the novel TDG are examined, demonstrating an important role for the masked carbonyl and ether functionalities. Detailed kinetic (RPKA) and mechanistic investigations determine the order in all reagents, and identify cyclopalladation as the turnover limiting step. Finally, the discovery of an unprecedented off-cycle free-amine directed ?-cyclopalladation of the arylation product is reported.

Synthesis of Indole-Dihydroisoquinoline Sulfonyl Ureas via Three-Component Reactions

Pearson, Stuart E.,Fillery, Shaun M.,Goldberg, Kristin,Demeritt, Julie E.,Eden, Jonathan,Finlayson, Jonathan,Patel, Anil

, p. 4963 - 4981 (2018/12/13)

Isoquinolines activated with sulfamoyl chlorides were reacted with indoles in a 3-component reaction to generate a library of dihydroisoquinoline derivatives. Using a differential protecting group strategy, products could be further derivatised. Synthesis of isoquinoline starting materials using several different methods is also described.

α-Amino Aldehydes as Readily Available Chiral Aldehydes for Rh-Catalyzed Alkyne Hydroacylation

Hooper, Joel F.,Seo, Sangwon,Truscott, Fiona R.,Neuhaus, James D.,Willis, Michael C.

supporting information, p. 1630 - 1634 (2016/02/20)

Readily available α-amino aldehydes, incorporating a methylthiomethyl (MTM) protecting group on nitrogen, are shown to be efficient substrates in Rh-catalyzed alkyne hydroacylation reactions. The reactions are performed under mild conditions, employing a small-bite-angle bis-phosphine ligand, allowing for good functional group tolerance with high stereospecificity. Amino aldehydes derived from glycine, alanine, valine, leucine, phenylalanine, isoleucine, serine, tryptophan, methionine, and cysteine were successfully employed, as was an enantiomerically enriched α-OMTM-aldehyde derived from phenyllactic acid. The synthetic utility of the α-amino enone products is demonstrated in a short enantioselective synthesis of the natural product sphingosine.

Gold-Catalyzed Fluorination–Hydration: Synthesis of α-Fluorobenzofuranones from 2-Alkynylphenol Derivatives

Wang, Qiang,Jiang, Yu,Sun, Run,Tang, Xiang-Ying,Shi, Min

supporting information, p. 14739 - 14745 (2016/10/03)

The AuI-catalyzed fluorination–hydration of 2-alkynylphenol derivatives in the presence of Selectfluor [1-chloromethyl-4-fluoro-1,4-diazoniabicyclo-[2.2.2]octane bis(tetrafluoroborate)] has been developed. This method provides straightforward a

Access to Polyfunctionalized Chiral Piperidines through Enantioselective Addition-Carbocyclization Cascade Reaction Catalyzed by a Rhodium(I)-Diene Complex

Serpier, Fabien,Brayer, Jean-Louis,Folléas, Beno?t,Darses, Sylvain

supporting information, p. 5496 - 5499 (2015/11/18)

A new addition-carbocyclization cascade reaction initiated by arylboronic acids and catalyzed by a rhodium/chiral diene complex is described. Starting from N-bridged oxoenoate derivatives, highly functionalized piperidines bearing three contiguous stereogenic centers were obtained with excellent enantio- and diastereoselectivities.

Vinyl dihydropyrans and dihydrooxazines: Cyclizations of catalytic ruthenium carbenes derived from alkynals and alkynones

Cambeiro, Fermin,Lopez, Susana,Varela, Jesus A.,Saa, Carlos

supporting information, p. 5959 - 5963 (2014/06/10)

A novel synthesis of 2-vinyldihydropyrans and dihydro-1,4-oxazines (morpholine derivatives) from alkynals and alkynones has been developed. The cyclizations require a mild generation of catalytic ruthenium carbenes from terminal alkynes and (trimethylsilyl)diazomethane followed by trapping with carbonyl nucleophiles. Mechanistic aspects of the new cyclizations are discussed. Setting a trap: A novel synthesis of 2-vinyldihydropyrans and dihydro-1,4-oxazines (morpholine derivatives) from alkynals and alkynones has been developed. The cyclizations require a mild generation of catalytic ruthenium carbenes from terminal alkynes and (trimethylsilyl)diazomethane followed by trapping with carbonyl nucleophiles.

Gold-catalyzed intramolecular regio- and enantioselective cycloisomerization of 1,1-bis(indolyl)-5-alkynes

Huang, Long,Yang, Hai-Bin,Zhang, Di-Han,Zhang, Zhen,Tang, Xiang-Ying,Xu, Qin,Shi, Min

supporting information, p. 6767 - 6771 (2013/07/25)

Bis(indole) alkaloids analogues were prepared under mild conditions and in high yields through a gold-catalyzed cycloisomerization of 1,1-bis(indolyl)-5- alkynes (see scheme). The enan Copyright

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