10406-05-0

Basic information

• Product Name: 5-Chloroindole-3-carboxylic acid
• Synonyms: 5-CHLOROINDOLE-3-CARBOXYLIC ACID;5-CHLORO-1H-INDOLE-3-CARBOXYLIC ACID;RARECHEM AL BE 0763;5-chloro-3-Indolecarboxylicacid;5-chloro-3-indole acid;1H-Indole-3-carboxylic acid, 5-chloro-;5-Chloro-1H-indol-3-carboxylic acid
• CAS NO: 10406-05-0
• Molecular Formula: C₉H₆ClNO₂
• Molecular Weight: 195.6
• Product Categories: pharmacetical;Indole
• Mol File: 10406-05-0.mol
• Article Data: 10

Chemical Properties

• Melting Point: 209-210℃
• Boiling Point: 449.7 °C at 760 mmHg
• Flash Point: 225.8 °C
• Appearance: /
• Density: 1.548 g/cm³
• Vapor Pressure: 7.12E-09mmHg at 25°C
• Refractive Index: 1.728
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 3.69±0.30(Predicted)
• CAS DataBase Reference: 5-Chloroindole-3-carboxylic acid(CAS DataBase Reference)
• NIST Chemistry Reference: 5-Chloroindole-3-carboxylic acid(10406-05-0)
• EPA Substance Registry System: 5-Chloroindole-3-carboxylic acid(10406-05-0)

Safety Data

• Hazard Codes: Xn
• Statements: 22
• Safety Statements: S22:; S26:; S36/37/39:
• Hazardous Substances Data: 10406-05-0(Hazardous Substances Data)

Usage

General Description

5-Chloroindole-3-carboxylic acid is a chemical compound with a molecular formula C9H6ClNO2. It is a derivative of indole, a heterocyclic aromatic organic compound. 5-Chloroindole-3-carboxylic acid is used in the synthesis of pharmaceuticals and research chemicals, particularly in the production of anti-cancer and anti-viral drugs. It is also utilized as a reagent in organic synthesis and as an intermediate in the preparation of various bioactive molecules. 5-Chloroindole-3-carboxylic acid has potential applications in medicinal chemistry, agrochemicals, and other industries due to its versatile and valuable chemical properties.

InChI:InChI=1/C9H6ClNO2/c10-5-1-2-8-6(3-5)7(4-11-8)9(12)13/h1-4,11H,(H,12,13)

Upstream product

• 17422-32-1 5-chloro-1H-indole 
• 407-25-0 trifluoroacetic anhydride 
• 1261024-31-0 5-chloro-1H-indole-3-carbaldehyde oxime 
• 194490-14-7 5-chloro-1H-indole-3-carbonitrile 
• 827-01-0 5-chloro-1H-indole-3-carboxaldehyde 
• 1419517-55-7 1-(5-chloro-1H-indol-3-yl)-2,2,2-trifluoroethanone 
• 10406-06-1 5-bromo-1H-indole-3-carboxylic acid 

Downstream Products

• 172595-67-4 methyl 5-chloro-1H-indole-3-carboxylate 
• 120-72-9 indole 
• 17422-32-1 5-chloro-1H-indole 
• 1404538-71-1 C₃₁H₃₃ClN₆O₅ 

Relevant articles and documents

Highly convenient and large scale synthesis of 5-chloroindole and its 3-substituted analogues

A large scale and commercially feasible synthesis of 5-chloroindole and its 3-substituted analogues has been described via a halogen - halogen exchange reaction from 5-bromoindole and its derivatives using cuprous chloride and dipolar aprotic solvent N-methyl-2-pyrrolidone in one pot with good yields.

Electrophilicity and nucleophilicity of commonly used aldehydes

The present approach for determining the electrophilicity (E) and nucleophilicity (N) of aldehydes includes a kinetic study of KMNO4 oxidation and NaBH4 reduction of aldehydes. A transition state analysis of the KMNO4 promoted aldehyde oxidation reaction has been performed, which shows a very good correlation with experimental results. The validity of the experimental method has been tested using the experimental activation parameters of the two reactions. The utility of the present approach is further demonstrated by the theoretical versus experimental relationship, which provides easy access to E and N values for various aldehydes and offers an at-a-glance assessment of the chemical reactivity of aldehydes in various reactions. the Partner Organisations 2014.

NOVEL BIS-INDOLIC DERIVATIVES, A PROCESS FOR PREPARING THE SAME AND THEIR USES AS A DRUG

The present invention relates to novel bis-indolic derivatives, processes for their preparation, and their potential use as new antibacterial drugs.