1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid

Basic Information

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CAS Number

91064-25-4

Molecular Formula

C11H9Cl2NO3

Molecular Weight

274.1 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1C(CN(C1=O)C2=CC(=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C11H9Cl2NO3/c12-8-2-1-7(4-9(8)13)14-5-6(11(16)17)3-10(14)15/h1-2,4,6H,3,5H2,(H,16,17)

InChIKey

WMACFMOMYRKMOJ-UHFFFAOYSA-N

LogP

2.4309000000000003

Topological Polar Surface Area

57.61 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

337

Safety Information

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Hazard Statement

Synonyms & References

English

1-(3,4-dichlorophenyl)-5-oxo-3-pyrrolidinecarboxylic Acid
1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid
AKOS000156627
STK674852
DB-353897
Z285224170
EN300-38871
91064-25-4
MFCD00665764
SR-01000522261-1
SR-01000522261
AKOS016040988
1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylicacid
CS-0206365
SCHEMBL7825178
BS-11827
Oprea1_357127
BBL022320
1-(3,4-dichlorophenyl)-5-oxopyrrolidine-3-carboxylic acid
1-(3,4-dichlorophenyl)-5-oxo-3-pyrrolidinecarboxylic acid
AG-205/12502022
ALBB-030639

MDL Number

MFCD00665764

Customs Code

2933790090

FAQ

What are the physical and chemical properties of 1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid (CAS: 91064-25-4)?

1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid is a white to off-white crystalline solid with a molecular weight of approximately 280.03 g/mol. It has a low solubility in water but is more soluble in organic solvents like methanol and acetonitrile. This compound is known for its stability, but it can undergo hydrolysis under basic conditions. It is also prone to esterification and amide formation reactions.

How is 1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid (CAS: 91064-25-4) typically synthesized?

1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid can be synthesized via a multi-step process involving the chlorination of a phenol followed by the formation of a pyrrolidine ring and the introduction of a carboxylic acid functionality. Commonly, this involves the use of acyl chlorides and amines as key reagents, with careful control of reaction conditions to ensure selectivity and high yield.

What industries use 1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid (CAS: 91064-25-4)?

1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid is used in the pharmaceutical industry for the synthesis of various medicinal compounds. It is also utilized in the polymer industry for the development of special polymers with enhanced properties, and in the sensor and semiconductor industries for electronic applications requiring specific chemical functionalities.

What precautions should be taken when handling 1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid (CAS: 91064-25-4)?

When handling 1-(3,4-Dichlorophenyl)-2-oxopyrrolidine-4-carboxylic acid, it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Handling should be conducted in a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using appropriate absorbent materials, and the area should be ventilated. Always refer to the Safety Data Sheet (SDS) for detailed safety information and emergency procedures.