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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)-

1,2-Benzisothiazol-3(2H)-one, 4-hydroxy-, 1,1-dioxide

O=C1NS(=O)(=O)c2c1c(O)ccc2 Request for Quotation
Chemical Name: 1,2-Benzisothiazol-3(2H)-one, 4-hydroxy-, 1,1-dioxide
CAS Number: 80563-77-5
Product Number: AG008MAP(AGN-PC-0K5X49)
Synonyms:
MDL No:
Molecular Formula: C7H5NO4S
Molecular Weight: 199.1839

Identification/Properties

Computed Properties
Molecular Weight:
199.18g/mol
XLogP3:
0.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
198.994g/mol
Monoisotopic Mass:
198.994g/mol
Topological Polar Surface Area:
91.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
331
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Hydroxy-1H-1,2-benzisothiazole-1,1,3(2H)-trione is a versatile compound widely used in chemical synthesis. This compound serves as a valuable building block in the development of various organic molecules due to its unique structure and properties.In chemical synthesis, 4-Hydroxy-1H-1,2-benzisothiazole-1,1,3(2H)-trione can act as a precursor for the synthesis of heterocyclic compounds. Its hydroxy and trione groups enable it to participate in a variety of reactions, including nucleophilic addition, condensation, and cyclization reactions. This versatility allows for the creation of complex molecular structures with diverse functionalities.Furthermore, the presence of the benzisothiazole ring in this compound imparts specific chemical and physical properties that are beneficial in the design of new materials and pharmaceuticals. The benzisothiazole moiety is known for its stability and compatibility with various functional groups, making it a valuable scaffold for molecular modifications and structural diversification.Overall, the application of 4-Hydroxy-1H-1,2-benzisothiazole-1,1,3(2H)-trione in chemical synthesis offers synthetic chemists a powerful tool for the construction of novel compounds with potential applications in drug discovery, material science, and other fields of research.