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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)-

Isothiazolo[5,4-c]pyridin-3(2H)-one, 1,1-dioxide

O=C1NS(=O)(=O)c2c1ccnc2 Request for Quotation
Chemical Name: Isothiazolo[5,4-c]pyridin-3(2H)-one, 1,1-dioxide
CAS Number: 142141-07-9
Product Number: AG001HV0(AGN-PC-003Y8C)
Synonyms:
MDL No:
Molecular Formula: C6H4N2O3S
Molecular Weight: 184.1726

Identification/Properties

Computed Properties
Molecular Weight:
184.169g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
183.994g/mol
Monoisotopic Mass:
183.994g/mol
Topological Polar Surface Area:
84.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
305
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


The compound, Isothiazolo[5,4-c]pyridin-3(2H)-one 1,1-dioxide, serves as a valuable building block in chemical synthesis due to its unique structural features and versatile reactivity. In organic chemistry, it is commonly utilized as a key intermediate for the construction of complex heterocyclic compounds with potential biological activities. Its cyclic nature and the presence of oxygen and sulfur atoms make it an attractive candidate for the development of novel pharmaceuticals, agrochemicals, and materials. Additionally, the functional groups present in this molecule can participate in a variety of reactions, enabling the formation of diverse molecular architectures. Its application in synthesis extends to the preparation of advanced materials, such as polymers and functionalized surfaces, showcasing its significance in modern chemical research and development.