CAS 1187385-62-1

1H-Pyrazole, 3-(1,1-dimethylethyl)-, hydrochloride (1:1)

Description:

1H-Pyrazole, 3-(1,1-dimethylethyl)-, hydrochloride (1:1) is a chemical compound characterized by its pyrazole core, which is a five-membered ring containing two adjacent nitrogen atoms. The presence of a tert-butyl group at the 3-position enhances its hydrophobic properties and may influence its biological activity. As a hydrochloride salt, it is typically more soluble in water compared to its free base form, which can facilitate its use in various applications, including pharmaceuticals and agrochemicals. The compound may exhibit specific pharmacological properties, making it of interest in medicinal chemistry. Its molecular structure allows for potential interactions with biological targets, and the hydrochloride form can improve stability and shelf-life. Safety data should be consulted for handling and usage, as with all chemical substances, to ensure proper precautions are taken. Overall, this compound represents a unique combination of structural features that may confer specific functional properties in chemical and biological contexts.

Formula: C₇H₁₂N₂·ClH

InChI: InChI=1S/C7H12N2.ClH/c1-7(2,3)6-4-5-8-9-6;/h4-5H,1-3H3,(H,8,9);1H

InChI key: InChIKey=UAMHULJGNXVTJP-UHFFFAOYSA-N

SMILES: C(C)(C)(C)C=1C=CNN1.Cl

Synonyms:

• 1H-Pyrazole, 3-(1,1-dimethylethyl)-, hydrochloride (1:1)

3-t-Butyl-1H-pyrazole hydrochloride

CAS: 1187385-62-1

Versatile small molecule scaffold

Formula: C₇H₁₃ClN₂

Purity: Min. 95%

Molecular weight: 160.64 g/mol

Ref: 3D-MXB38562