CAS 858523-45-2
:1-(4-Bromo-3-methylphenyl)-1H-pyrazole
Description:
1-(4-Bromo-3-methylphenyl)-1H-pyrazole, identified by its CAS number 858523-45-2, is an organic compound characterized by its pyrazole core, which is a five-membered ring containing two adjacent nitrogen atoms. This compound features a 4-bromo-3-methylphenyl substituent, indicating the presence of a bromine atom and a methyl group on a phenyl ring that is attached to the pyrazole. The bromine atom contributes to its reactivity and potential applications in various chemical reactions, while the methyl group can influence its solubility and stability. This compound is typically used in medicinal chemistry and material science due to its unique structural properties, which may impart biological activity or facilitate interactions with other molecules. Its synthesis often involves multi-step organic reactions, and it may be characterized using techniques such as NMR spectroscopy, mass spectrometry, and infrared spectroscopy to confirm its structure and purity. Overall, 1-(4-Bromo-3-methylphenyl)-1H-pyrazole represents a versatile building block in the development of pharmaceuticals and agrochemicals.
Formula:C10H9BrN2
InChI:InChI=1S/C10H9BrN2/c1-8-7-9(3-4-10(8)11)13-6-2-5-12-13/h2-7H,1H3
InChI key:InChIKey=OYVREJGACKLFDP-UHFFFAOYSA-N
SMILES:CC=1C=C(C=CC1Br)N2C=CC=N2
Synonyms:- 1H-Pyrazole, 1-(4-bromo-3-methylphenyl)-
- 1-(4-Bromo-3-methylphenyl)pyrazole
- 1-(4-Bromo-3-methylphenyl)-1H-pyrazole
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