Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate

Base Information

• Chemical Name: Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate
• CAS No.: 5863-20-7
• Molecular Formula: C₇H₁₀N₂O₄S
• Molecular Weight: 218.233
• Hs Code.: 2933990090
• ChEMBL ID: CHEMBL1727500
• DSSTox Substance ID: DTXSID00594737
• Wikidata: Q82489643
• Mol file: 5863-20-7.mol

Synonyms:5863-20-7;Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate;ethyl 5-methyl-2H-1,2,6-thiadiazine-3-carboxylate 1,1-dioxide;ethyl 3-methyl-1,1-dioxo-2H-1,2,6-thiadiazine-5-carboxylate;Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda6-1,2,6-thiadiazine-3-carboxylate;MLS002603737;CHEMBL1727500;DTXSID00594737;HMS3102C24;MFCD08443997;STK351662;AKOS005072000;AKOS005167664;CA-0929;UPCMLD24ALIJ001083:001;SMR001522467;EN300-231311;J-520888;ethyl5-methyl-2H-1,2,6-thiadiazine-3-carboxylate1,1-dioxide;Ethyl 3-methyl-2H-1,2,6-thiadiazine-5-carboxylate 1,1-dioxide;ethyl 5-methyl-1,1-dioxo-2H-1??,2,6-thiadiazine-3-carboxylate;ethyl 3-methyl-1,1-dioxo-2H-1lambda6,2,6-thiadiazine-5-carboxylate;Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-2,6-thiadiazine-3-carboxylate;ethyl 5-methyl-1,1-dioxo-2H-1lambda6,2,6-thiadiazine-3-carboxylate;Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~2,6-thiadiazine-3-carboxylate;Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda6-2,6-thiadiazine-3-carboxylate

Chemical Property of Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate

Chemical Property:

• Melting Point: 99～101℃
• PSA: 93.21000
• LogP: 0.58750
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 218.03612798
• Heavy Atom Count: 14
• Complexity: 402

Purity/Quality:

98%min ^*data from raw suppliers

Ethyl 1,6-dihydro-1,1-dioxo-5-methyl-1,2,6-thiadiazine-3-carboxylate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NS(=O)(=O)NC(=C1)C

Technology Process of Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate

There total 2 articles about Ethyl 5-methyl-1,1-dioxo-1,6-dihydro-1lambda~6~,2,6-thiadiazine-3-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

ethyl 2,4-diketopentanoate (615-79-2) → 3-Ethoxycarbonyl-5-methyl-(2H)-1,2,6-thiadiazin-1,1-dioxid (5863-20-7)

Guidance literature:

With hydrogenchloride; SULFAMIDE; In ethanol;

DOI:10.1021/jo01030a059

Reference yield:

→ 3-Ethoxycarbonyl-5-methyl-(2H)-1,2,6-thiadiazin-1,1-dioxid (5863-20-7)

Guidance literature:

AcCH2CO-CO2Et, Sulfamid/HCl;

upstream raw materials:

ethyl 2,4-diketopentanoate

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