CAS 1648864-32-7

1-Oxa-7-azaspiro[4.4]nonane-7-carboxylic acid, 3-[[(4-methylphenyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester

Description:

1-Oxa-7-azaspiro[4.4]nonane-7-carboxylic acid, 3-[[(4-methylphenyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester is a complex organic compound characterized by its unique spirocyclic structure, which incorporates both nitrogen and oxygen heteroatoms. The presence of the oxa and aza groups indicates that the molecule contains an ether and an amine functional group, contributing to its potential reactivity and solubility properties. The sulfonate group attached to the aromatic ring enhances the compound's polarity, which may influence its interaction with biological systems and solvents. The tert-butyl ester functionality suggests that the compound may exhibit lipophilic characteristics, potentially affecting its pharmacokinetics if used in medicinal chemistry. Overall, this compound's structural features suggest it may have applications in drug development or as a chemical intermediate, although specific biological activities or applications would require further investigation. Its CAS number, 1648864-32-7, allows for precise identification in chemical databases and literature.

Formula: C₁₉H₂₇NO₆S

InChI: InChI=1S/C19H27NO6S/c1-14-5-7-16(8-6-14)27(22,23)26-15-11-19(24-12-15)9-10-20(13-19)17(21)25-18(2,3)4/h5-8,15H,9-13H2,1-4H3

InChI key: InChIKey=RXOSUIMABBXDSP-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)N1CC2(CC(OS(=O)(=O)C3=CC=C(C)C=C3)CO2)CC1

Synonyms:

• 1-Oxa-7-azaspiro[4.4]nonane-7-carboxylic acid, 3-[[(4-methylphenyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 3-[[(4-methylphenyl)sulfonyl]oxy]-1-oxa-7-azaspiro[4.4]nonane-7-carboxylate