CAS 1040687-56-6

N-[2-[2,4-Bis(1,1-dimethylethyl)phenoxy]ethyl]-4-fluorobenzenamine

Description:

N-[2-[2,4-Bis(1,1-dimethylethyl)phenoxy]ethyl]-4-fluorobenzenamine, identified by its CAS number 1040687-56-6, is a chemical compound characterized by its complex structure, which includes a fluorobenzene moiety and a phenoxy group. This compound features a tertiary amine, which contributes to its potential as a ligand in various chemical reactions. The presence of bulky tert-butyl groups enhances its steric properties, potentially influencing its solubility and reactivity. The fluorine atom in the para position of the benzene ring can affect the electronic properties of the molecule, possibly enhancing its lipophilicity and altering its interaction with biological targets. This compound may be of interest in pharmaceutical research or materials science due to its unique structural features. However, specific applications and biological activities would depend on further studies and characterization. As with any chemical substance, proper handling and safety protocols should be observed, considering its potential reactivity and toxicity.

Formula: C₂₂H₃₀FNO

InChI: InChI=1S/C22H30FNO/c1-21(2,3)16-7-12-20(19(15-16)22(4,5)6)25-14-13-24-18-10-8-17(23)9-11-18/h7-12,15,24H,13-14H2,1-6H3

InChI key: InChIKey=INOZNEOCKAGAJP-UHFFFAOYSA-N

SMILES: C(C)(C)(C)C1=C(OCCNC2=CC=C(F)C=C2)C=CC(C(C)(C)C)=C1

Synonyms:

• Benzenamine, N-[2-[2,4-bis(1,1-dimethylethyl)phenoxy]ethyl]-4-fluoro-
• N-[2-[2,4-Bis(1,1-dimethylethyl)phenoxy]ethyl]-4-fluorobenzenamine