907602-77-1

Basic information

• Product Name: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester
• Synonyms: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester;tert-Butyl 3-(2-cyanopropan-2-yl)-5-methoxy-1H-indole-1-carboxylate
• CAS NO: 907602-77-1
• Molecular Formula: C18H22 N2 O3
• Molecular Weight: 0
• Mol File: 907602-77-1.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 455.1°C at 760 mmHg
• Flash Point: 229°C
• Appearance: /
• Density: 1.08g/cm³
• Vapor Pressure: 1.8E-08mmHg at 25°C
• Refractive Index: 1.534
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester(907602-77-1)
• EPA Substance Registry System: 1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-methoxy-, 1,1-dimethylethyl ester(907602-77-1)

Safety Data

• Hazardous Substances Data: 907602-77-1(Hazardous Substances Data)

Usage

Structure

1H-Indole-1-carboxylic acid derivative with a 3-(1-cyano-1-methylethyl)-5-methoxy group and a 1,1-dimethylethyl ester group

Type

Ester compound

Usage

Commonly used in organic synthesis and pharmaceutical research due to its potential biological activities

Potential properties

May possess various pharmacological properties

Synthesis

Could be used as a building block in the synthesis of novel drug molecules

Applications

Potential applications in the field of agrochemicals and materials science.

InChI:InChI=1/C18H22N2O3/c1-17(2,3)23-16(21)20-10-14(18(4,5)11-19)13-9-12(22-6)7-8-15(13)20/h7-10H,1-6H3

Upstream product

• 896101-79-4 3-(cyanomethyl)-5-methoxy-1H-indol-1-carboxylic acid tertbutyl ester 
• 74-88-4 methyl iodide 

Downstream Products

• 13608-23-6 6-methoxy-4,4-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole 
• 896101-81-8 2-(5-methoxy-1H-indol-3-yl)-2-methylpropanonitrile 

Relevant articles and documents

Substituted heteroaryl compounds and compositions and uses thereof

The present invention relates to a novel heteroaromatic compound, and a pharmaceutical composition containing the compound. The heteroaromatic compound or pharmaceutical composition containing the compound can be used for exciting a melatonin receptor. The present invention also relates to a preparation method of the compound and pharmaceutical composition thereof, and application of the compound and pharmaceutical composition in treating central nervous system dysfunction of mammals especially human.

The discovery of carboline analogs as potent MAPKAP-K2 inhibitors

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