CAS 79128-69-1

Methyl 3-[(2,2-dimethyl-1-oxopropyl)amino]-2-thiophenecarboxylate

Description:

Methyl 3-[(2,2-dimethyl-1-oxopropyl)amino]-2-thiophenecarboxylate, identified by its CAS number 79128-69-1, is a chemical compound characterized by its unique structure that includes a thiophene ring, a carboxylate group, and an amine substituent. The presence of the thiophene moiety contributes to its potential applications in organic synthesis and pharmaceuticals due to the ring's electron-rich nature, which can participate in various chemical reactions. The compound features a methyl ester functional group, which enhances its solubility in organic solvents and may influence its reactivity. The dimethylated propylamine side chain suggests potential biological activity, possibly affecting its interaction with biological targets. Overall, this compound's structural characteristics may provide insights into its reactivity, solubility, and potential applications in medicinal chemistry or as an intermediate in organic synthesis. However, specific properties such as melting point, boiling point, and spectral data would require experimental determination or literature reference for precise characterization.

Formula: C₁₁H₁₅NO₃S

InChI: InChI=1S/C11H15NO3S/c1-11(2,3)10(14)12-7-5-6-16-8(7)9(13)15-4/h5-6H,1-4H3,(H,12,14)

InChI key: InChIKey=UMECWUPJPGGLTL-UHFFFAOYSA-N

SMILES: C(OC)(=O)C1=C(NC(C(C)(C)C)=O)C=CS1

Synonyms:

• 2-Thiophenecarboxylic acid, 3-[(2,2-dimethyl-1-oxopropyl)amino]-, methyl ester
• Methyl 3-[(2,2-dimethyl-1-oxopropyl)amino]-2-thiophenecarboxylate