97820-51-4

Basic information

• Product Name: 1H-Indole,5-(1-methylethyl)-(9CI)
• Synonyms: 1H-Indole,5-(1-methylethyl)-(9CI);5-isopropyl-1H-indole;5-(1-Methylethyl)-1H-indole;5-(Propan-2-yl)-1H-indole
• CAS NO: 97820-51-4
• Molecular Formula: C₁₁H₁₃N
• Molecular Weight: 159.231
• Product Categories: ISOPROPYL
• Mol File: 97820-51-4.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 281.3±9.0 °C(Predicted)
• Appearance: /
• Density: 1.047±0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• PKA: 17.10±0.30(Predicted)
• CAS DataBase Reference: 1H-Indole,5-(1-methylethyl)-(9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Indole,5-(1-methylethyl)-(9CI)(97820-51-4)
• EPA Substance Registry System: 1H-Indole,5-(1-methylethyl)-(9CI)(97820-51-4)

Safety Data

• Hazardous Substances Data: 97820-51-4(Hazardous Substances Data)

Usage

General Description

1H-Indole, 5-(1-methylethyl)-(9CI) is a chemical compound also known as 5-isopropylindole. It is an indole derivative that belongs to the class of organic compounds known as indoles. 1H-Indole,5-(1-methylethyl)-(9CI) is commonly used as a precursor to the synthetic production of various pharmaceuticals and agrochemicals. It has also been found to have potential applications in the field of medicinal chemistry, particularly in the development of new drugs. 1H-Indole, 5-(1-methylethyl)-(9CI) possesses interesting properties that make it a valuable building block in the synthesis of diverse organic compounds, which contributes to its importance in the field of chemistry and industry.

Upstream product

• 102-71-6 triethanolamine 
• 99-88-7 4-Isopropylaniline 
• 162100-48-3 5-isopropyl-1-trifluoroacetylindole 
• 205192-94-5 N-[(2,2-dimethoxyethyl)amino]-4-(2-propyl)aniline 
• 10075-50-0 5-bromo-1H-indole 
• 77047-87-1 isopropylzinc(II) bromide 
• 75-30-9 2-iodo-propane 
• 16066-91-4 5-iodo-1H-indole 

Downstream Products

• 65826-96-2 5-(2-Propyl)indoline 
• 209682-78-0 (R)-3-[(N-Benzyloxycarbonylpyrrolidin-2-yl)carbonyl]-5-isopropyl-1H-indole 
• 156281-04-8 N,N-Dimethyl-5-isopropyl-1H-indole-3-ethanamine 

Relevant articles and documents

Highly selective palladium-catalyzed cross-coupling of secondary alkylzinc reagents with heteroaryl halides

The highly selective palladium-catalyzed Negishi coupling of secondary alkylzinc reagents with heteroaryl halides is described. The development of a series of biarylphosphine ligands has led to the identification of an improved catalyst for the coupling of electron-deficient heterocyclic substrates. Preparation and characterization of oxidative addition complex (L)(Ar)PdBr provided insight into the unique reactivity of catalysts based on CPhos-type ligands in facilitating challenging reductive elimination processes.

Nickel-catalyzed Negishi cross-coupling reactions of secondary alkylzinc halides and aryl iodides

A general Ni-catalyzed process for the cross-coupling of secondary alkylzinc halides and aryl/heteroaryl iodides has been developed. This is the first process to overcome the isomerization and β-hydride elimination problems that are associated with the use of secondary nucleophiles, and that have limited the analogous Pd-catalyzed systems. The impact of salt additives was also investigated. It was found that the presence of LiBF4 dramatically improves both isomeric retention and yield for challenging substrates.(Figure Presented)

5-ALKYL INDOLE COMPOUNDS

Described herein are compounds selective for the 5-HT 1D-like receptor, which have the general formula: STR1 wherein: R 1 is linear or branched loweralkyl;R 2 is selected from a group of Formula II, III, IV and V: STR2 R 3 is selected from H and loweralkyl; R 4 is selected from H and loweralkyl; One of R. sup. 5 and R 6 is H and the other is independently selected from H, loweralkoxy, loweralkyl and hydroxy; andn is 1-3; or a salt, solvate or hydrate thereof.Also described is the use of these compounds as pharmaceuticals to treat indications where stimulation of the 5-HT 1D-like receptor is implicated, such as migraine.