CAS 1286274-27-8

1,1-Dimethylethyl 4-[(3-fluoro-2-nitrophenoxy)methyl]-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 4-[(3-fluoro-2-nitrophenoxy)methyl]-1-piperidinecarboxylate, identified by its CAS number 1286274-27-8, is a chemical compound that features a piperidine ring, which is a six-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a dimethyl group, contributing to its steric bulk, and a nitrophenoxy moiety, which introduces both electron-withdrawing and potential reactivity due to the nitro group. The fluorine atom in the structure enhances the compound's lipophilicity and may influence its biological activity. The ester functional group, indicated by the carboxylate portion, suggests potential for hydrolysis and reactivity with nucleophiles. Overall, this compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry. Its specific characteristics, such as solubility, melting point, and reactivity, would depend on the molecular interactions and the environment in which it is studied.

Formula: C₁₇H₂₃FN₂O₅

InChI: InChI=1S/C17H23FN2O5/c1-17(2,3)25-16(21)19-9-7-12(8-10-19)11-24-14-6-4-5-13(18)15(14)20(22)23/h4-6,12H,7-11H2,1-3H3

InChI key: InChIKey=IVFGFFUZCOWNHS-UHFFFAOYSA-N

SMILES: O(CC1CCN(C(OC(C)(C)C)=O)CC1)C2=C(N(=O)=O)C(F)=CC=C2

Synonyms:

• 1,1-Dimethylethyl 4-[(3-fluoro-2-nitrophenoxy)methyl]-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 4-[(3-fluoro-2-nitrophenoxy)methyl]-, 1,1-dimethylethyl ester

tert-Butyl 4-[(3-fluoro-2-nitrophenoxy)methyl]piperidine-1-carboxylate

CAS: 1286274-27-8

Formula: C₁₇H₂₃FN₂O₅

Purity: 95.0%

Molecular weight: 354.378

Ref: 10-F063818