CAS 114415-26-8

5-Dodecyl-2-[4-(octyloxy)phenyl]pyrimidine

Description:

5-Dodecyl-2-[4-(octyloxy)phenyl]pyrimidine is an organic compound characterized by its complex structure, which includes a pyrimidine ring substituted with a dodecyl chain and a phenyl group that is further substituted with an octyloxy group. This compound exhibits amphiphilic properties due to the presence of both hydrophobic (dodecyl and octyloxy chains) and hydrophilic (pyrimidine ring) components, making it potentially useful in applications such as surfactants, emulsifiers, or in the formulation of liquid crystals. The long alkyl chains contribute to its solubility in organic solvents, while the pyrimidine moiety may participate in hydrogen bonding and π-π interactions, influencing its behavior in various chemical environments. Additionally, the presence of the octyloxy group can enhance its stability and solubility in non-polar solvents. Overall, this compound's unique structural features suggest potential utility in materials science and organic synthesis, particularly in the development of functionalized materials or as intermediates in chemical reactions.

Formula: C₃₀H₄₈N₂O

InChI: InChI=1S/C30H48N2O/c1-3-5-7-9-11-12-13-14-15-17-19-27-25-31-30(32-26-27)28-20-22-29(23-21-28)33-24-18-16-10-8-6-4-2/h20-23,25-26H,3-19,24H2,1-2H3

InChI key: InChIKey=DIESLOGOXULNIV-UHFFFAOYSA-N

SMILES: C(CCCCCCCCCCC)C=1C=NC(=NC1)C2=CC=C(OCCCCCCCC)C=C2

Synonyms:

• Pyrimidine, 5-dodecyl-2-[4-(octyloxy)phenyl]-
• 5-Dodecyl-2-[4-(octyloxy)phenyl]pyrimidine

Pyrimidine, 5-dodecyl-2-[4-(octyloxy)phenyl]-

CAS: 114415-26-8

Formula: C₃₀H₄₈N₂O

Molecular weight: 452.7149

Ref: IN-DA000BAL