1H-1,2,4-Triazole, 3-(chloromethyl)-1-methyl-, monohydrochloride


Chemical Name: 1H-1,2,4-Triazole, 3-(chloromethyl)-1-methyl-, monohydrochloride
CAS Number: 135206-76-7
Product Number: AG007ZOO(AGN-PC-0PKIUH)
Synonyms:
MDL No:
Molecular Formula: C4H7Cl2N3
Molecular Weight: 168.0245

Identification/Properties


Computed Properties
Molecular Weight:
168.021g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
167.002g/mol
Monoisotopic Mass:
167.002g/mol
Topological Polar Surface Area:
30.7A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
77.7
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback


Chemical Structure



3-(Chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride is a versatile compound widely utilized in chemical synthesis processes due to its unique reactivity and functional properties. In the realm of organic chemistry, this compound serves as a valuable building block in the construction of diverse molecular structures, offering a crucial intermediate for the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals.One of the key applications of 3-(Chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride lies in its role as a reactive intermediate for the introduction of the 1,2,4-triazole moiety into target molecules. This functionality enables chemists to modify and enhance the properties of organic compounds, leading to the development of novel materials with desired characteristics. Furthermore, its reactivity towards nucleophiles and ability to undergo substitution reactions make it a valuable tool for the creation of structurally complex molecules.Moreover, 3-(Chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride finds use as a key component in the synthesis of bioactive compounds, including fungicides, herbicides, and pharmaceutical agents. By incorporating this compound into the molecular structure of the desired product, chemists can tailor its biological activity and optimize its efficacy for specific applications. This highlights the significance of 3-(Chloromethyl)-1-methyl-1H-1,2,4-triazole hydrochloride in the field of medicinal chemistry and agrochemical research, showcasing its importance as a versatile tool for chemical synthesis.