1H-Pyrazole-3-acetic acid, monohydrochloride


Chemical Name: 1H-Pyrazole-3-acetic acid, monohydrochloride
CAS Number: 118054-57-2
Product Number: AG008TNU(AGN-PC-0PBE0Z)
Synonyms:
MDL No:
Molecular Formula: C5H7ClN2O2
Molecular Weight: 162.5743

Identification/Properties


Computed Properties
Molecular Weight:
162.573g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
162.02g/mol
Monoisotopic Mass:
162.02g/mol
Topological Polar Surface Area:
66A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
116
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

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NMR Spectrum


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Chemical Structure



The 2-(1H-Pyrazol-3-yl)acetic acid hydrochloride is a versatile compound widely utilized in chemical synthesis processes. This specialized compound demonstrates remarkable reactivity and specificity in various synthetic pathways, making it a valuable tool in the production of organic compounds with complex structures. In particular, 2-(1H-Pyrazol-3-yl)acetic acid hydrochloride has shown significant utility as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Its unique chemical properties enable precise control over reaction conditions and facilitate the formation of desired molecular architectures. Whether employed as a catalyst, reagent, or building block, this compound plays a crucial role in the efficient and selective synthesis of diverse chemical compounds.