147636-36-0

Basic information

• Product Name: 1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID
• Synonyms: 1-(TOLUENE-4-SULFONYL)-PIPERIDINE-4-CARBOXYLIC ACID;1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID;1-[(4-METHYLPHENYL)SULFONYL]PIPERIDINE-4-CARBOXYLIC ACID;AKOS BBS-00001481;ASISCHEM U52287;1-Tosylpiperidine-4-carboxylic acid;1-(4-methylphenyl)sulfonylisonipecotic acid;4R-1329
• CAS NO: 147636-36-0
• Molecular Formula: C₁₃H₁₇NO₄S
• Molecular Weight: 283.34
• Mol File: 147636-36-0.mol
• Article Data: 6

Chemical Properties

• Melting Point: 167-169°C
• Boiling Point: 477.6°Cat760mmHg
• Flash Point: 242.6°C
• Appearance: /
• Density: 1.328g/cm³
• Vapor Pressure: 6.28E-10mmHg at 25°C
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 4.38±0.20(Predicted)
• CAS DataBase Reference: 1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID(147636-36-0)
• EPA Substance Registry System: 1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID(147636-36-0)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 147636-36-0(Hazardous Substances Data)

Usage

General Description

1-[(4-Methylphenyl)sulfonyl]-4-piperidinecarboxylic acid is a chemical compound with the molecular formula C16H21NO4S. It belongs to the class of organic compounds known as phenylpiperidines, which are compounds containing a piperidine ring attached to a phenyl group. 1-[(4-METHYLPHENYL)SULFONYL]-4-PIPERIDINECARBOXYLIC ACID is a white to off-white crystalline powder that is sparingly soluble in water. It is commonly used as a pharmaceutical intermediate in the synthesis of various drugs. The compound is also known for its potential therapeutic properties, including anti-inflammatory and anti-cancer effects, and it is under investigation for its potential in treating various medical conditions.

InChI:InChI=1/C13H17NO4S/c1-10-2-4-12(5-3-10)19(17,18)14-8-6-11(7-9-14)13(15)16/h2-5,11H,6-9H2,1H3,(H,15,16)/p-1

Upstream product

• 2446-83-5 di-isopropyl azodicarboxylate 
• 870-50-8 di-tert-butyl-diazodicarboxylate 
• 93431-41-5 1-(4-toluenesulfonyl)-piperidine-4-carbonitrile 
• 498-94-2 isonipecotic acid 
• 98-59-9 p-toluenesulfonyl chloride 
• 1126-09-6 4-carbethoxypiperidine 
• 297180-07-5 4-ethoxycarbonyl-1-(4-methylphenylsulfonyl)piperidine 

Downstream Products

• 1624333-19-2 4-(pent-4-en-1-yl)-1-tosylpiperidine-4-carboxylic acid 
• 1624333-45-4 1-tosyl-4-((trifluoromethyl)thio)piperidine 
• 1274845-59-8 1-(1-p-toluenesulfonylpiperidin-4-yl)ethan-1-one 
• 92324-30-6 1-(1-p-toluenesulfonylpiperidin-4-yl)ethan-1-ol 
• 886497-75-2 1-tosylpiperidin-4-amine 
• 632-56-4 tetraethyl ethane-1,1,2,2-tetracarboxylate 
• 347885-68-1 4-bromo-1-tosylpiperidine 

Relevant articles and documents

Access to functionalized luminescent Pt(ii) complexes by photoredox-catalyzed Minisci alkylation of 6-aryl-2,2′-bipyridines

Photoredox-mediated C-H bond alkylation of 6-aryl-2,2′-bipyridines withN-(acyloxy)phthalimides is reported. The reaction exhibits excellent functional group tolerance, including chiral aliphatic groups. The influence of the incorporatedC6′-alkyl group on

Radical Deuteration with D2O: Catalysis and Mechanistic Insights

Selective incorporation of deuterium atoms into molecules is of high interest for labeling purposes and for optimizing properties of drug candidates. A mild and environmentally benign method for the deuteration of alkyl iodides via radical pathway using D2O as source of deuterium has been developed. The reaction is initiated and mediated by triethylborane in the presence of dodecanethiol as a catalyst. This method is compatible with a wide range of functional groups and provides the monodeuterated products in good yields and with a high level of deuterium incorporation. It opens promising opportunities for the development of enantioselective radical reactions. Moreover, a revision of the mechanism of the deoxygenation reaction of xanthates using R3B and water (Wood deoxygenation) is presented.

Nitrilase-catalyzed enantioselective synthesis of pyrrolidine- And piperidinecarboxylic acids

The enantioselective synthesis of the nonproteinogenic amino acids β-proline and nipecotic acids from their readily available nitriles is achieved in high enantiomeric excess by commercially available nitrilases. The presented procedure comprises not more than 4 steps, thus considerably reducing the multiple steps generally required. Amide formation is also observed for specific heterocyclic nitriles.