3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid

Basic Information

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CAS Number

60693-31-4

Molecular Formula

C11H9NO4

Molecular Weight

219.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H9NO4/c13-9-4-5-10(14)12(9)8-3-1-2-7(6-8)11(15)16/h1-3,6H,4-5H2,(H,15,16)

InChIKey

BEQRYKGDEGNALQ-UHFFFAOYSA-N

LogP

1.0382

Topological Polar Surface Area

74.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

323

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid
3-(2,5-Dioxo-pyrrolidin-1-yl)-benzoic acid
1-(3-Carboxyphenyl)-pyrrolidin-2,5-dion
3-(2,5-dioxo-1-pyrrolidinyl)benzoic acid
3-(2,5-dioxoazolidinyl)benzoic acid
3-(2,5-dioxopyrrolidin-1-yl)benzoic acid(SALTDATA: FREE)
3-succinimidebenzoic acid
3-Succinimido-benzoesaeure
3-succinimido-benzoic acid
AC1LETYJ
AC1Q5U3M
AG-G-20526
Enamine_005131
Cambridge id 5631823
PD180802
AKOS000112869
MLS000061625
UNII-7U968NU7T5
EN300-00143
SR-01000413050
G61823
A868911
SCHEMBL20053775
7U968NU7T5
3-(2,5-dioxopyrrolidin-1-yl)benzoicacid
STK155926
SMR000069955
F1265-0223
HMS1408J05
AG-205/11370333
AB00091283-01

MDL Number

MFCD00523325

FAQ

What are the physical and chemical properties of 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS: 60693-31-4)?

3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is a solid crystalline compound with a molecular weight of approximately 226.23 g/mol. It has low solubility in water but is soluble in polar solvents like methanol and dimethylformamide. The compound is moderately reactive and may undergo hydrolysis in the presence of water or acid. It has a pKa of around 4.5, indicating its acidity.

How is 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS: 60693-31-4) typically synthesized?

3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is usually synthesized by the condensation of 2,5-dioxopyrrolidine with benzoic anhydride. The reaction takes place in the presence of a catalyst such as p-toluenesulfonic acid. The yield is typically around 75-80%, and the product can be purified by recrystallization from organic solvents.

What industries use 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS: 60693-31-4)?

3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid is utilized in the pharmaceutical industry for the synthesis of various compounds. It is also used in the development of sensors and semiconductors due to its unique chemical properties. Additionally, it has potential applications in the polymer industry for the modification of polymer properties.

What precautions should be taken when handling 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid (CAS: 60693-31-4)?

When handling 3-(2,5-Dioxopyrrolidin-1-yl)benzoic acid, it is important to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Handle the compound in a well-ventilated area, preferably under a fume hood, to avoid inhalation of dust or vapors. In case of a spill, immediately clean up using appropriate absorbent materials and follow local safety protocols. Always consult the Safety Data Sheet (SDS) for detailed safety information.