CAS 1383601-79-3

4-Phenyl-1-(prop-2-yn-1-yl)-1H-imidazole

CAS: 1383601-79-3

4-Phenyl-1-(prop-2-yn-1-yl)-1H-imidazole is a sustainable metallacycle that contains a cyclopropane ring. It has been shown to have high uptake and thermally activated allylamine group p2 (CPA). This molecule has been crystallized in the x-ray crystal structures of both the ground state and the CPA, which are available on the website. The crystallography algorithm was used to obtain these structures and it is also outlined on the website. The functional theory was applied to these structures, which showed that this molecule can be reduced by hydrogenation or reductive elimination. 4-Phenyl-1-(prop-2-yn-1-yl)-1H-imidazole is hydrophilic due to its resonance stabilizing effect.

Formula: C₁₂H₁₀N₂

Purezza: Min. 95%

Peso molecolare: 182.22 g/mol

Ref: 3D-IFC60179