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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

ethyl 1,1,4-trioxothiane-3-carboxylate

CCOC(=O)C1CS(=O)(=O)CCC1=O Request for Quotation
Chemical Name: ethyl 1,1,4-trioxothiane-3-carboxylate
CAS Number: 889946-17-2
Product Number: AG00466I(AGN-PC-079GVH)
Synonyms:
MDL No:
Molecular Formula: C8H12O5S
Molecular Weight: 220.2429

Identification/Properties

Properties
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
220.239g/mol
XLogP3:
-0.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
220.041g/mol
Monoisotopic Mass:
220.041g/mol
Topological Polar Surface Area:
85.9A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
337
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate 1,1-dioxide, also known as $name$, is a versatile compound widely utilized in chemical synthesis. Its unique structure enables it to serve as a key building block in the production of various pharmaceuticals, agrochemicals, and fine chemicals. In chemical synthesis, $name$ acts as a valuable intermediate for the preparation of complex organic molecules. Its sulfur-containing heterocyclic ring provides a reactive site for functionalization reactions, allowing chemists to introduce specific functional groups with precision. This functionality makes $name$ a valuable tool for the synthesis of sulfur-containing compounds with diverse applications.Moreover, the presence of both a carbonyl group and an ester group in $name$ offers opportunities for further derivatization through reactions such as esterification, reduction, and substitution. This flexibility allows synthetic chemists to access a wide range of derivatives and analogs, tailored for specific purposes in medicinal chemistry, material science, and other fields requiring custom-designed molecules.Overall, the application of Ethyl 4-oxotetrahydro-2H-thiopyran-3-carboxylate 1,1-dioxide as a versatile intermediate in chemical synthesis highlights its significance in modern organic chemistry and underscores its role in advancing the development of innovative compounds with diverse functionalities and applications.