1(2H)-Isoquinolinone, 6-methoxy-


Chemical Name: 1(2H)-Isoquinolinone, 6-methoxy-
CAS Number: 26829-43-6
Product Number: AG007MLX(AGN-PC-03H972)
Synonyms:
MDL No:
Molecular Formula: C10H9NO2
Molecular Weight: 175.1840

Identification/Properties


Computed Properties
Molecular Weight:
175.187g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
175.063g/mol
Monoisotopic Mass:
175.063g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
237
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



6-Methoxyisoquinolin-1(2H)-one is a versatile compound that finds widespread application in chemical synthesis. One of its prominent uses is as a key building block in the preparation of various biologically active molecules and pharmaceutical compounds. By serving as a scaffold for the attachment of different functional groups, this compound enables the synthesis of a diverse range of potential drug candidates.Furthermore, 6-Methoxyisoquinolin-1(2H)-one serves as a valuable intermediate in the construction of heterocyclic compounds, which are essential in medicinal chemistry research. Its unique structure imparts specific reactivity that allows for selective functionalization, making it a valuable tool for organic chemists in the design and synthesis of complex molecules.In addition, the presence of the methoxy group enhances the compound's solubility and stability, further facilitating its use in various synthetic pathways. Overall, the versatility and reactivity of 6-Methoxyisoquinolin-1(2H)-one make it a valuable asset in chemical synthesis, particularly in the development of new pharmaceuticals and bioactive compounds.