CAS 76738-64-2

rel-(αR,βS)-β-[(4-Chlorophenyl)methyl]-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol

Description:

The chemical substance known as rel-(αR,βS)-β-[(4-Chlorophenyl)methyl]-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol, with the CAS number 76738-64-2, is a triazole derivative characterized by its complex molecular structure, which includes a triazole ring and various functional groups. This compound typically exhibits properties such as moderate solubility in organic solvents and potential bioactivity, making it of interest in pharmaceutical and agricultural applications. The presence of the 4-chlorophenyl group may contribute to its biological activity, while the triazole moiety is often associated with antifungal properties. The stereochemistry indicated by the rel-(αR,βS) notation suggests specific spatial arrangements of atoms, which can influence the compound's reactivity and interaction with biological targets. Overall, this substance is likely to be studied for its potential therapeutic effects, particularly in areas related to plant protection or as a pharmaceutical agent.

Formula: C₁₅H₂₀ClN₃O

InChI: InChI=1/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3/t13-,14-/s2

InChI key: InChIKey=RMOGWMIKYWRTKW-ZCWZLOQUNA-N

SMILES: [C@H](CC1=CC=C(Cl)C=C1)([C@@H](C(C)(C)C)O)N2C=NC=N2

Synonyms:

• 1H-1,2,4-Triazole-1-ethanol, β-[(4-chlorophenyl)methyl]-α-(1,1-dimethylethyl)-, (R*,S*)-
• Er-Pac
• rel-(αR,βS)-β-[(4-Chlorophenyl)methyl]-α-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol
• 1H-1,2,4-Triazole-1-ethanol, β-[(4-chlorophenyl)methyl]-α-(1,1-dimethylethyl)-, (R*,S*)-(±)-
• 1H-1,2,4-Triazole-1-ethanol, β-[(4-chlorophenyl)methyl]-α-(1,1-dimethylethyl)-, (αR,βS)-rel-

Paclobutrazol Impurity 4

CAS: 76738-64-2

Formula: C₁₅H₂₀ClN₃O

Color and Shape: White To Off-White Solid

Molecular weight: 293.80

Ref: 4Z-P-192006