CAS 85909-08-6

1-Pyrrolidinecarboxylic acid, 2-oxo-, 1,1-dimethylethyl ester

Description:

1-Pyrrolidinecarboxylic acid, 2-oxo-, 1,1-dimethylethyl ester, commonly referred to as a derivative of pyrrolidine, is an organic compound characterized by its pyrrolidine ring structure, which is a five-membered nitrogen-containing heterocycle. This compound features a carboxylic acid functional group and an ester linkage, specifically with a tert-butyl group, which contributes to its stability and lipophilicity. It is typically a colorless to pale yellow liquid or solid, depending on its purity and form. The presence of the 2-oxo group indicates a carbonyl functionality, which can influence its reactivity and interactions in various chemical environments. This compound may be utilized in organic synthesis, particularly in the development of pharmaceuticals or agrochemicals, due to its potential as a building block in complex molecular architectures. Its properties, such as solubility and boiling point, can vary based on the specific conditions and purity of the sample. Safety data should be consulted for handling and storage, as with all chemical substances.

Formula: C₉H₁₅NO₃

InChI: InChI=1S/C9H15NO3/c1-9(2,3)13-8(12)10-6-4-5-7(10)11/h4-6H2,1-3H3

InChI key: InChIKey=GJJYYMXBCYYXPQ-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)N1C(=O)CCC1

Synonyms:

• 1,1-Dimethylethyl 2-oxo-1-pyrrolidinecarboxylate
• 1-(tert-Butoxycarbonyl)-2-oxopyrrolidine
• 1-(tert-Butoxycarbonyl)pyrrolidin-2-one
• 1-Pyrrolidinecarboxylic acid, 2-oxo-, 1,1-dimethylethyl ester
• 2-Oxopyrrolidine-1-carboxylic acid tert-butyl ester
• N-(tert-Butoxycarbonyl)pyrrolidin-2-one
• N-(tert-Butyloxycarbonyl)pyrrolidin-2-one
• N-Boc-2-pyrrolidinone
• N-tert-Butoxycarbonyl-2-oxopyrrolidine
• Nsc 662770
• Tert-Butyl 2-Oxopyrrolidine-1-Carboxylate

tert-Butyl 2-oxopyrrolidine-1-carboxylate

CAS: 85909-08-6

Formula: C₉H₁₅NO₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 185.2203

Ref: IN-DA0036DZ

tert-Butyl 2-Oxopyrrolidine-1-carboxylate

CAS: 85909-08-6

Formula: C₉H₁₅NO₃

Purity: >98.0%(T)(HPLC)

Color and Shape: White or Colorless to Light yellow to Light orange powder to lump to clear liquid

Molecular weight: 185.22

Ref: 3B-B6082

Pyrrolidin-2-one, N-BOC protected

CAS: 85909-08-6

Pyrrolidin-2-one, N-BOC protected

Formula: C₉H₁₅NO₃

Purity: 95%

Color and Shape: pale yellow liquid

Molecular weight: 185.22g/mol

Ref: 54-OR60029

tert-Butyl 2-oxopyrrolidine-1-carboxylate

CAS: 85909-08-6

Formula: C₉H₁₅NO₃

Purity: 95%

Color and Shape: Liquid

Molecular weight: 185.223

Ref: 10-F209938

N-Boc-2-pyrrolidinone

Controlled Product

CAS: 85909-08-6

Applications N-Boc-2-pyrrolidinone is a useful synthetic intermediate. It can be used to prepare highly functionalized N-acyl-2-vinylpyrrolidines by a 4-component Ugi reaction (isocyanide, carbonyl compounds, primary amines, carboxylic acids). It can also be used to synthesize the naturally occurring Maillard flavors via catalytic SeO2 oxidation.
References Banfi, L., et al.: J. Org. Chem., 73, 1608 (2008); Fuganti, C., et al.: Tetrahedron, 63, 4762 (2007)

Formula: C₉H₁₅NO₃

Color and Shape: Neat

Molecular weight: 185.22

Ref: TR-B665945