4-bromo-1-cyclopropylpyrazole


Chemical Name: 4-bromo-1-cyclopropylpyrazole
CAS Number: 1151802-23-1
Product Number: AG000GDW(AGN-PC-09C5YS)
Synonyms:
MDL No:
Molecular Formula: C6H7BrN2
Molecular Weight: 187.0372

Identification/Properties


Computed Properties
Molecular Weight:
187.04g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
185.979g/mol
Monoisotopic Mass:
185.979g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
114
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

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Chemical Structure



In chemical synthesis, 4-Bromo-1-cyclopropyl-1H-pyrazole serves as a versatile building block and intermediate. This compound plays a crucial role in the preparation of various biologically active molecules and complex organic compounds. Its cyclopropyl and bromo functional groups are key features that enable it to participate in a wide range of synthetic reactions, including cross-coupling reactions, cycloadditions, and metal-catalyzed transformations.The presence of the cyclopropyl ring provides rigidity and unique steric properties to the molecule, allowing chemists to fine-tune the reactivity and selectivity of reactions. Additionally, the bromo substituent can serve as a handle for further functionalization, facilitating the introduction of additional chemical groups at specific positions in the molecular structure.Overall, 4-Bromo-1-cyclopropyl-1H-pyrazole is a valuable tool in the hands of synthetic chemists, enabling the efficient construction of complex molecules with diverse applications in medicinal chemistry, material science, and agrochemical research.