133747-57-6

Basic information

• Product Name: 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID
• Synonyms: IFLAB-BB F1799-0544;5-OXO-1-(4-TOLYL)PYRROLIDINE-3-CARBOXYLIC ACID;5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID;AKOS BB-6984;1-(4-METHYLPHENYL)-5-OXO-3-PYRROLIDINECARBOXYLIC ACID;1-(4-METHYLPHENYL)-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID;3-pyrrolidinecarboxylic acid, 1-(4-methylphenyl)-5-oxo-;1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxylic acid(SALTDATA: FREE)
• CAS NO: 133747-57-6
• Molecular Formula: C₁₂H₁₃NO₃
• Molecular Weight: 219.24
• Mol File: 133747-57-6.mol

Chemical Properties

• Melting Point: 187-188 °C
• Boiling Point: 518.5 °C at 760 mmHg
• Flash Point: 267.4 °C
• Appearance: /
• Density: 1.297g/cm³
• Vapor Pressure: 1.41E-11mmHg at 25°C
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 4.45±0.20(Predicted)
• CAS DataBase Reference: 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID(133747-57-6)
• EPA Substance Registry System: 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID(133747-57-6)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 133747-57-6(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Research:
5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID is used as a key intermediate in the synthesis of various pharmaceutical drugs and research compounds. Its unique chemical structure allows for the development of novel therapeutic agents with potential applications in treating a wide range of diseases and conditions.
Used in Organic Synthesis:
In the field of organic synthesis, 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID is utilized as a valuable building block for the creation of complex organic molecules. Its presence of a tolyl group and carboxylic acid functionality enables the formation of diverse chemical entities, contributing to the advancement of organic chemistry.
Used in Drug Development:
5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID is employed as a precursor in the development of new drugs, offering a foundation for the design and synthesis of innovative therapeutic agents. Its potential applications in drug development highlight its importance in the pharmaceutical industry, as it can contribute to the discovery of novel treatments for various medical conditions.
Used in Medicinal Chemistry:
In medicinal chemistry, 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID is utilized as a structural component in the design of bioactive molecules. Its unique features, such as the tolyl group and carboxylic acid functionality, provide opportunities for the creation of compounds with specific biological activities, making it a valuable asset in the development of new pharmaceutical agents.
Overall, 5-OXO-1-P-TOLYL-PYRROLIDINE-3-CARBOXYLIC ACID is a versatile chemical compound with significant applications in various fields, including pharmaceutical research, organic synthesis, drug development, and medicinal chemistry. Its unique structure and functional groups make it a promising building block for the creation of novel therapeutic agents and the advancement of scientific knowledge.

InChI:InChI=1/C12H13NO3/c1-8-2-4-10(5-3-8)13-7-9(12(15)16)6-11(13)14/h2-5,9H,6-7H2,1H3,(H,15,16)/p-1/t9-/m1/s1

Upstream product

• 97-65-4 2-methylenesuccinic acid 
• 106-49-0 p-toluidine 

Downstream Products

• 1071383-00-0 C₁₄H₁₇NO₃ 
• 1188542-45-1 1,3-dipropyl-8-[1-(1-p-tolylpyrrolidin-3-ylmethyl)-1H-pyrazol-4-yl]-3,7-dihydropurine-2,6-dione 
• 1188542-06-4 8-[1-(5-oxo-1-p-tolylpyrrolidin-3-ylmethyl)-1H-pyrazol-4-yl]-1,3-dipropyl-3,7-dihydropurine-2,6-dione 

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