3(2H)-Isothiazolone, 5-(aminomethyl)-


Chemical Name: 3(2H)-Isothiazolone, 5-(aminomethyl)-
CAS Number: 62020-54-6
Product Number: AG00EEJD(AGN-PC-0BS7TZ)
Synonyms:
MDL No:
Molecular Formula: C4H6N2OS
Molecular Weight: 130.1682

Identification/Properties


Properties
MP:
>140°C (dec)
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
130.165g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
130.02g/mol
Monoisotopic Mass:
130.02g/mol
Topological Polar Surface Area:
80.4A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
143
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


NMR Spectrum


Other Analytical Data


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Chemical Structure



5-(Aminomethyl)isothiazol-3(2H)-one, also known as AMI, is a versatile chemical compound widely utilized in chemical synthesis. One of its key applications lies in its role as a highly effective antimicrobial agent. AMI is commonly employed in the formulation of various antimicrobial products, such as paints, coatings, and personal care products.In chemical synthesis, AMI serves as a valuable building block in the creation of diverse organic compounds. Its functional groups and reactivity make it an attractive candidate for incorporation into complex molecules. AMI can participate in a range of reactions, including condensation, ring closure, and substitution reactions, leading to the formation of novel chemical structures.Furthermore, AMI's presence in the synthesis of pharmaceuticals and agrochemicals highlights its importance in the development of new therapeutic agents and crop protection products. By incorporating AMI into molecular frameworks, chemists can explore different pathways to access biologically active compounds with potential applications in medicine and agriculture.Overall, the use of 5-(Aminomethyl)isothiazol-3(2H)-one in chemical synthesis showcases its significance as a versatile and valuable building block with diverse applications in the creation of innovative materials and compounds.