4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid

Basic Information

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CAS Number

17057-04-4

Molecular Formula

C11H7NO4

Molecular Weight

217.18 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

Boiling Point

447.1°C at 760 mmHg

Density

1.521

Flash Point

224.2°C

SMILES

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C1=CC(=CC=C1C(=O)O)N2C(=O)C=CC2=O

InChI

InChI=1S/C11H7NO4/c13-9-5-6-10(14)12(9)8-3-1-7(2-4-8)11(15)16/h1-6H,(H,15,16)

InChIKey

LKUOJDGRNKVVFF-UHFFFAOYSA-N

LogP

0.8141999999999999

Topological Polar Surface Area

74.68 Å²

Hydrogen Bond Donor/Acceptor

1 / 5

Complexity

348

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

SR-01000081632-1
EINECS 241-117-9
79D4NT6S3E
4-(2,5-Dihydro-2,5-dioxo-1H-pyrrol-1-yl)benzoic acid
4-(2,5-DIOXO-2,5-DIHYDRO-PYRROL-1-YL)-BENZOICACID
4-(2,5-Dioxo-2,5-dihydro-1-pyrrolyl)benzoic Acid
CCG-17662
HY-W104848
4-(2,5-dioxopyrrol-1-yl)benzoic acid
N-(para-carboxyphenyl) maleimide
BDBM155509
4-(2,5-dioxoazolinyl)benzoic acid
4-maleimido-benzoic acid
FT-0604072
M3257
UNII-79D4NT6S3E
F1265-0503
EN300-09658
BB 0218877
N-(4-Carboxyphenyl)maleimide
NSC-521355
4-(2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl)-benzoic acid
CHEMBL169518
A3763
NSC521355
SCHEMBL235166
AB00074231-01
MFCD00458571
Benzoic acid, 4-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-
SY101256
US9011882, Table 1, Compound 2

MDL Number

MFCD00458571

Customs Code

2925190090

FAQ

What is 4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid (CAS: 17057-04-4)?

4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid, also known as 4-(5-oxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid, is a chemical compound with the CAS number 17057-04-4. It is a white crystalline powder with a molecular formula of C10H5NO4 and a molecular weight of 203.17 g/mol. This compound is characterized by its acidic nature and is used in various applications including pharmaceuticals and research.

What are the main uses of 4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid (CAS: 17057-04-4)?

4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid is primarily used in the pharmaceutical industry as an intermediate in the synthesis of drugs. It is also utilized in research for its potential biological activities and in the chemical industry for its acidic properties.

Is 4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid (CAS: 17057-04-4) safe?

4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid is generally considered safe when handled properly. However, it is important to follow safety guidelines, including wearing appropriate personal protective equipment such as gloves and goggles, and ensuring the area is well-ventilated. Proper storage and disposal methods should also be followed to minimize health risks.

How should 4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid (CAS: 17057-04-4) be stored?

4-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoic acid should be stored in a cool, dry place away from direct sunlight and sources of heat. The container should be tightly sealed to prevent moisture and air exposure. It should be kept in a secure and labeled container to avoid accidental ingestion or contact with skin and eyes.