1-(Azetidin-3-yl)-1H-pyrazole hydrochloride


Chemical Name: 1-(Azetidin-3-yl)-1H-pyrazole hydrochloride
CAS Number: 1221715-95-2
Product Number: AG0016V9(AGN-PC-0WAGS6)
Synonyms:
MDL No:
Molecular Formula: C6H11Cl2N3
Molecular Weight: 196.0776

Identification/Properties


Computed Properties
Molecular Weight:
196.075g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
195.033g/mol
Monoisotopic Mass:
195.033g/mol
Topological Polar Surface Area:
29.8A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
101
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:
3
Compound Is Canonicalized:
Yes

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NMR Spectrum


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Chemical Structure



1-(Azetidin-3-yl)-1H-pyrazole dihydrochloride is a versatile compound with a wide range of applications in chemical synthesis. It is commonly used as a key building block in the development of various pharmaceuticals, agrochemicals, and other fine chemicals. Due to its unique structural features, this compound serves as a valuable intermediate in the synthesis of complex organic molecules. Its distinct reactivity allows for the introduction of functional groups and modifications, making it a valuable tool in the creation of novel chemical entities. Furthermore, its presence in the molecular structure often imparts desirable properties and biological activities to the final products. In the field of drug discovery and development, 1-(Azetidin-3-yl)-1H-pyrazole dihydrochloride plays a crucial role in the preparation of potential therapeutic agents with diverse pharmacological profiles. Additionally, its use in material science and other industrial applications highlights its significance in advancing various scientific disciplines.