CAS 1211517-70-2

1,1-Dimethylethyl 4-amino-2,6-dichloro-3-pyridinecarboxylate

Description:

1,1-Dimethylethyl 4-amino-2,6-dichloro-3-pyridinecarboxylate, identified by its CAS number 1211517-70-2, is a chemical compound that features a pyridine ring substituted with amino and dichloro groups, as well as an ester functional group. This compound is characterized by its relatively complex structure, which includes a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk. The presence of the amino group suggests potential for hydrogen bonding, which may influence its solubility and reactivity. The dichloro substitutions on the pyridine ring can enhance its biological activity and may also affect its electronic properties. Typically, compounds of this nature are studied for their potential applications in pharmaceuticals or agrochemicals, given the presence of both nitrogen and halogen atoms, which are often associated with bioactivity. Additionally, the stability and reactivity of this compound can be influenced by environmental factors such as pH and temperature, making it important to consider these conditions in practical applications.

Formula: C₁₀H₁₂Cl₂N₂O₂

InChI: InChI=1S/C10H12Cl2N2O2/c1-10(2,3)16-9(15)7-5(13)4-6(11)14-8(7)12/h4H,1-3H3,(H2,13,14)

InChI key: InChIKey=FQBUGUYSADBAAD-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)C=1C(N)=CC(Cl)=NC1Cl

Synonyms:

• 3-Pyridinecarboxylic acid, 4-amino-2,6-dichloro-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 4-amino-2,6-dichloro-3-pyridinecarboxylate