6636-06-2

Basic information

• Product Name: 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID
• Synonyms: TIMTEC-BB SBB000262;5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID
• CAS NO: 6636-06-2
• Molecular Formula: C₁₁H₉NO₂
• Molecular Weight: 187.19
• Mol File: 6636-06-2.mol
• Article Data: 6

Chemical Properties

• Melting Point: 206-208 °C (decomp)
• Boiling Point: 452.3°Cat760mmHg
• Flash Point: 227.4°C
• Appearance: /
• Density: 1.285g/cm³
• Vapor Pressure: 5.7E-09mmHg at 25°C
• Refractive Index: 1.636
• Storage Temp.: 2-8°C
• PKA: 4.45±0.10(Predicted)
• CAS DataBase Reference: 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID(6636-06-2)
• EPA Substance Registry System: 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID(6636-06-2)

Safety Data

• Hazard Codes: Xi,Xn
• Statements: 22
• HazardClass: IRRITANT
• Hazardous Substances Data: 6636-06-2(Hazardous Substances Data)

Usage

General Description

5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID is a chemical compound with the molecular formula C11H9NO2. It is a derivative of pyrrole and is a carboxylic acid with a phenyl group attached to the 5th position. 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID has potential pharmaceutical applications and may be used as a building block in the synthesis of various organic compounds. It may also have biological activities and could be of interest in medicinal chemistry research. 5-PHENYL-1H-PYRROLE-2-CARBOXYLIC ACID is a white to light yellow solid at room temperature and is sparingly soluble in water. It is important to handle this compound with care and follow proper safety protocols when working with it in a laboratory setting.

InChI:InChI=1/C11H9NO2/c13-11(14)10-7-6-9(12-10)8-4-2-1-3-5-8/h1-7,12H,(H,13,14)

Upstream product

• 70958-09-7 2,2,2-trifluoro-1-(5-phenyl-1H-pyrrol-2-yl)ethanone 
• 541-41-3 chloroformic acid ethyl ester 
• 952-27-2 5-Ethoxycarbonyl-2-phenyl-Δ¹-pyrroline 
• 108-86-1 bromobenzene 
• 3042-22-6 2-phenyl-1H-pyrrole 
• 13355-43-6 5-phenyl-1H-pyrrole-2-carboxylic acid ethyl ester 
• 153783-18-7 Ethyl (S)-2-(tert-butoxycarbonylamino)-5-phenyl-5-oxopentanoate 
• 144978-35-8 (S)-ethyl N-tert-butoxycarbonylpyroglutamate 
• 153783-23-4 (S)-5-Ethoxycarbonyl-2-phenyl-Δ¹-pyrroline 

Downstream Products

• 3042-22-6 2-phenyl-1H-pyrrole 
• 52179-72-3 5-phenyl-1H-pyrrole-2-carboxylic acid methyl ester 
• 1261298-37-6 5-phenyl-N-[2-(1-piperidinylcarbonyl)phenyl]-1H-pyrrole-2-carboxamide 
• 1261298-40-1 5-phenyl-2-[2-(1-piperidinylcarbonyl)phenyl]-2,3-dihydro-1H-pyrrolo[1,2-c]imidazol-1-one 
• 1057214-93-3 5-phenyl-1H-pyrrole-2-carboxylic acid (1-isopropyl-piperidin-4-yl)-amide 
• 934353-30-7 3-[(5-phenyl-1H-pyrrole-2-carbonyl)-amino]-propionic acid 
• 934353-34-1 2-phenyl-6,7-dihydropyrrolo[2,3-c]azepine-4,8(1H,5H)-dione 
• 934353-25-0 3-[(5-phenyl-1H-pyrrole-2-carbonyl)-amino]-propionic acid methyl ester 
• 368210-50-8 5-phenylpyrrolo-2-carboxylic acid chloride 

Relevant articles and documents

Synthesis of 5-Arylpyrrole-2-carboxylic Acids as Key Intermediates for NBD Series HIV-1 Entry Inhibitors

5-Arylpyrrole-2-carboxylic acids are important key intermediates in the synthesis of HIV-1 entry inhibitors (such as NBD-11021 and NBD-14010). Here we present a general method for the synthesis of some 5-arylpyrrole-2-carboxylic acids in three steps starting from pyrrole. By this method, the compounds could be prepared on gram scale and without chromatographic purification.

NMR and conformational studies of new 5-phenylpyrrole-carboxamide derivatives

The 1H and 13C NMR resonances of 22 5-(5-substituted-2-nitrophenyl)-1H-pyrrole-2-carboxamides, 22 5-(5-substituted-2-aminophenyl)-1H-pyrrole-2-carboxamides, and 9 5-phenyl-1H-pyrrole-2-carboxamides we

General method for the synthesis of 5-arylpyrrole-2-carboxylic acids

5-Arylpyrrole-2-carboxylic acids are prepared by DDQ oxidative aromatization of the corresponding ethyl 2-aryl-Δ1-pyrroline-5-carboxylate followed by basic hydrolysis.