4513-93-3

Basic information

• Product Name: 3,5-Dimethylpyrrole-2-carboxylic acid
• Synonyms: RARECHEM AL BE 1013;TIMTEC-BB SBB005435;BUTTPARK 36\18-24;3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLIC ACID;3,5-DIMETHYLPYRROLE-2-CARBOXYLIC ACID;1H-Pyrrole-2-carboxylicacid, 3,5-diMethyl-;2-Carboxy-3,5-dimethyl-1H-pyrrole;3,5-dimethyl-1H-pyrrole-2-carboxylate, sodium salt
• CAS NO: 4513-93-3
• Molecular Formula: C₇H₉NO₂
• Molecular Weight: 139.15
• Product Categories: Pharmaceutial intermediates
• Mol File: 4513-93-3.mol
• Article Data: 2

Chemical Properties

• Melting Point: 124-126°C
• Boiling Point: 318.427 °C at 760 mmHg
• Flash Point: 146.38 °C
• Appearance: /
• Density: 1.233 g/cm³
• Vapor Pressure: 0.000151mmHg at 25°C
• Refractive Index: 1.574
• Storage Temp.: 2-8°C(protect from light)
• PKA: 5.37±0.50(Predicted)
• CAS DataBase Reference: 3,5-Dimethylpyrrole-2-carboxylic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 3,5-Dimethylpyrrole-2-carboxylic acid(4513-93-3)
• EPA Substance Registry System: 3,5-Dimethylpyrrole-2-carboxylic acid(4513-93-3)

Safety Data

• Hazard Codes: Xi
• Safety Statements: 24/25
• Hazardous Substances Data: 4513-93-3(Hazardous Substances Data)

Usage

General Description

3,5-Dimethylpyrrole-2-carboxylic acid is a chemical compound that belongs to the pyrrole-2-carboxylic acid family. It is a derivative of pyrrole, a five-membered aromatic heterocyclic organic compound. 3,5-Dimethylpyrrole-2-carboxylic acid is characterized by the presence of a carboxylic acid group and two methyl groups attached to the pyrrole ring at the 3rd and 5th positions. 3,5-Dimethylpyrrole-2-carboxylic acid has potential applications in pharmaceuticals, organic synthesis, and materials science. It is used as a building block in the preparation of various drugs, bioactive compounds, and organic materials. Studies have also shown that this compound possesses antibacterial and antifungal properties, making it a promising candidate for the development of new antimicrobial agents.

InChI:InChI=1/C7H9NO2/c1-4-3-5(2)8-6(4)7(9)10/h3,8H,1-2H3,(H,9,10)

Upstream product

• 15719-64-9 methylammonium carbonate 
• 40236-19-9 benzyl 3,5-dimethylpyrrole-2-carboxylate 
• 2199-44-2 3,5-dimethyl-2-ethoxycarbonyl-1H-pyrrole 

Downstream Products

• 625-82-1 2,4-dimethyl-1H-pyrrole 
• 463-79-6 carbonic-acid 
• 1500-93-2 1-(3,5-dimethyl-1H-pyrrol-2-yl)ethan-1-one 
• 136992-07-9 3-(5-[5-Bromo-3-ethyl-4-methyl-pyrrol-(2Z)-ylidenemethyl]-2-{5-[1-(3,5-dimethyl-1H-pyrrol-2-yl)-meth-(Z)-ylidene]-3-ethyl-4-methyl-5H-pyrrol-2-ylmethyl}-4-methoxycarbonylmethyl-1H-pyrrol-3-yl)-propionic acid methyl ester; hydrobromide 
• 1093254-89-7 N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide 
• 1093254-90-0 N-({4-chloro-3-[(3-chloro-5-cyanophenyl)oxy]-2-fluorophenyl}methyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide trifluoroacetate 
• 1111085-38-1 C₂₆H₂₄FN₃O₃ 
• 1094342-69-4 3-chloro-5-[(6-chloro-3-{[5-(3,5-dimethyl-1H-pyrrol-2-yl)-1,3,4-oxadiazol-2-yl]methyl}-2-fluorophenyl)oxy]benzonitrile 
• 2199-58-8 3,5-dimethylpyrrole-2-carbaldehyde 

Relevant articles and documents

Production of anticancer polyenes through precursor-directed biosynthesis

The biosynthesis of the pyrrolyl moiety of the fungal metabolite rumbrin originates from pyrrole-2-carboxylic acid. In an effort to produce novel derivatives with enhanced biological activity a series of substituted pyrrole-2-carboxylates were synthesised