39547-16-5

Basic information

• Product Name: 3-(5-Methoxy-1H-indol-3-yl)-propionic acid
• Synonyms: 3-(5-Methoxy-1H-indol-3-yl)-propionic acid;3-(5-methoxy-1H-indol-3-yl)propanoic acid
• CAS NO: 39547-16-5
• Molecular Formula: C₁₂H₁₃NO₃
• Molecular Weight: 219.23652
• Mol File: 39547-16-5.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 449.7°Cat760mmHg
• Flash Point: 225.8°C
• Appearance: /
• Density: 1.29g/cm³
• Vapor Pressure: 7.12E-09mmHg at 25°C
• Refractive Index: 1.636
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 3-(5-Methoxy-1H-indol-3-yl)-propionic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(5-Methoxy-1H-indol-3-yl)-propionic acid(39547-16-5)
• EPA Substance Registry System: 3-(5-Methoxy-1H-indol-3-yl)-propionic acid(39547-16-5)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 39547-16-5(Hazardous Substances Data)

Usage

InChI:InChI=1/C12H13NO3/c1-16-9-3-4-11-10(6-9)8(7-13-11)2-5-12(14)15/h3-4,6-7,13H,2,5H2,1H3,(H,14,15)

Upstream product

• 474640-47-6 3-(1-methanesulfonyl-5-methoxy-2,3-dihydro-1H-indol-3-yl)-propionic acid ethyl ester 
• 1006-94-6 5-methoxylindole 
• 79-10-7 acrylic acid 
• 104-94-9 4-methoxy-aniline 
• 611-10-9 2-ethoxycarbonyl-1-cyclopentanone 
• 90858-80-3 ethyl 3-(3-ethoxy-3-oxopropyl)-5-methoxy-1H-indole-2-carboxylate 
• 100394-23-8 3-(2-carboxyethyl)-5-methoxy-1H-indole-2-carboxylic acid 
• 474640-46-5 4-ethoxythiocarbonylsulfanyl-5-[methanesulfonyl-(4-methoxy-phenyl)-amino]-pentanoic acid ethyl ester 
• 23004-83-3 N-(4-methoxyphenyl)-N-(prop-2-en-1-yl)methanesulfonamide 
• 76834-78-1 ethyl 3-(5-Methoxy-1H-indol-3-yl)propionate 

Downstream Products

• 73-31-4 5-methoxy-N-acetyl-tryptamine 
• 76834-78-1 ethyl 3-(5-Methoxy-1H-indol-3-yl)propionate 

Relevant articles and documents

Selective Synthesis of Six Products from a Single Indolyl α-Diazocarbonyl Precursor

Indolyl α-diazocarbonyls can be selectively cyclized to give six distinct products through the careful choice of catalyst and reaction conditions. A range of catalysts were used, including complexes of RhII, PdII, and CuII, as well as SiO2, to promote diazo decomposition and subsequent cyclization/rearrangement through a range of mechanistic pathways.

Radical-Mediated Dearomatization of Indoles with Sulfinate Reagents for the Synthesis of Fluorinated Spirocyclic Indolines

The dearomative introduction of trifluoromethyl and 1,1-difluoroethyl radicals, generated from their corresponding sulfinate salts, into the C2 position of indole derivatives allows the diastereoselective synthesis of three-dimensional 3,3-spirocyclic indolines over C-H functionalized indoles.

PPAR ACTIVE COMPOUNDS

Compounds are described that are active on PPARs, including pan-active compounds. Also described are methods for developing or identifying compounds having a desired selectivity profile.