CAS 890091-62-0

Ethyl hexahydro-3,3-dimethyl-1H-pyrrolizine-1-carboxylate

Description:

Ethyl hexahydro-3,3-dimethyl-1H-pyrrolizine-1-carboxylate, identified by its CAS number 890091-62-0, is a chemical compound that belongs to the class of pyrrolizines, which are bicyclic compounds featuring a nitrogen atom in their structure. This substance typically exhibits characteristics such as being a colorless to pale yellow liquid with a distinctive odor. It is soluble in organic solvents and may have limited solubility in water due to its hydrophobic nature. The compound is often studied for its potential applications in organic synthesis and as an intermediate in the production of various pharmaceuticals or agrochemicals. Its structure, featuring a carboxylate ester functional group, suggests it may participate in reactions typical of esters, such as hydrolysis or transesterification. Safety data indicates that, like many organic compounds, it should be handled with care, as it may pose health risks if inhaled or ingested. Proper safety protocols should be followed when working with this substance in a laboratory setting.

Formula: C₁₂H₂₁NO₂

InChI: InChI=1S/C12H21NO2/c1-4-15-11(14)9-8-12(2,3)13-7-5-6-10(9)13/h9-10H,4-8H2,1-3H3

InChI key: InChIKey=KKHJUVUUBQTBMI-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C1C2N(C(C)(C)C1)CCC2

Synonyms:

• Ethyl hexahydro-3,3-dimethyl-1H-pyrrolizine-1-carboxylate
• 1H-Pyrrolizine-1-carboxylic acid, hexahydro-3,3-dimethyl-, ethyl ester