CAS 83039-57-0

Benzoic acid, 4-methyl-, 2,5-dioxo-1-pyrrolidinyl ester

Description:

Benzoic acid, 4-methyl-, 2,5-dioxo-1-pyrrolidinyl ester, also known by its CAS number 83039-57-0, is an organic compound characterized by its ester functional group derived from benzoic acid and a pyrrolidine moiety. This compound typically exhibits a white to off-white crystalline appearance and is soluble in organic solvents, reflecting its hydrophobic nature due to the aromatic ring. The presence of the pyrrolidine ring contributes to its potential biological activity, making it of interest in medicinal chemistry. The dioxo substituents indicate the presence of two carbonyl groups, which can influence the compound's reactivity and stability. In terms of applications, such esters may be explored for their roles in pharmaceuticals, agrochemicals, or as intermediates in organic synthesis. Safety data should be consulted for handling, as with many organic compounds, it may pose risks such as irritation or toxicity. Overall, this compound exemplifies the diverse chemistry of esters and their functional derivatives.

Formula: C₁₂H₁₁NO₄

InChI: InChI=1S/C12H11NO4/c1-8-2-4-9(5-3-8)12(16)17-13-10(14)6-7-11(13)15/h2-5H,6-7H2,1H3

InChI key: InChIKey=STJGCFDYPNABQG-UHFFFAOYSA-N

SMILES: O(C(=O)C1=CC=C(C)C=C1)N2C(=O)CCC2=O

Synonyms:

• 2,5-Pyrrolidinedione, 1-[(4-methylbenzoyl)oxy]-
• Succinimido p-methylbenzoate
• 2,5-Dioxopyrrolidin-1-yl 4-methylbenzoate
• Succinimido p-toluate
• Benzoic acid, 4-methyl-, 2,5-dioxo-1-pyrrolidinyl ester