62936-23-6

Basic information

• Product Name: 5-CHLOROVANILLIC ACID
• Synonyms: 5-CHLORO-3-METHOXY-4-HYDROXYBENZOIC ACID;5-CHLOROVANILLIC ACID;3-CHLOROVANILLIC ACID;LABOTEST-BB LT00455301;RARECHEM AL BE 0696;5-Chloro-4-hydroxy-3-methoxybenzoic acid;5-Chlorovanilic acid;3-chloro-4-hydroxy-5-methoxybenzoic acid
• CAS NO: 62936-23-6
• Molecular Formula: C₈H₇ClO₄
• Molecular Weight: 202.59
• EINECS: 263-766-7
• Product Categories: Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts
• Mol File: 62936-23-6.mol
• Article Data: 1

Chemical Properties

• Melting Point: 240-242°C
• Boiling Point: 290.9°C (rough estimate)
• Flash Point: 166.9 °C
• Appearance: Lurid powder
• Density: 1.4100 (rough estimate)
• Vapor Pressure: 1.44E-05mmHg at 25°C
• Refractive Index: 1.4327 (estimate)
• BRN: 2648897
• CAS DataBase Reference: 5-CHLOROVANILLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 5-CHLOROVANILLIC ACID(62936-23-6)
• EPA Substance Registry System: 5-CHLOROVANILLIC ACID(62936-23-6)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38-36
• Safety Statements: 26-37
• Hazardous Substances Data: 62936-23-6(Hazardous Substances Data)

Usage

General Description

5-Chlorovanillic acid is a chemical compound with the molecular formula C8H7ClO4. It is a derivative of vanillic acid, with a chlorine atom substituted at the 5th position on the aromatic ring. It is often used as an intermediate in the synthesis of pharmaceuticals and agrochemicals. 5-CHLOROVANILLIC ACID has also shown potential as an antioxidant and has been studied for its potential health benefits. Additionally, 5-chlorovanillic acid has been identified as a metabolite in the breakdown of various chlorinated aromatic compounds in the environment. Overall, this chemical has a range of applications in the fields of chemistry, pharmaceuticals, and environmental science.

InChI:InChI=1/C8H7ClO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12)

Upstream product

• 19463-48-0 5-chlorovanillin 
• 121-34-6 3-methoxy-4-hydroxybenzoic acid 

Downstream Products

• 1272527-74-8 4-(3-chloro-4,5-diisopropoxybenzamido)-2-fluorobenzoic acid 
• 712294-48-9 3-chloro-4-ethoxy-5-methoxybenzoic acid 
• 1272527-76-0 4-(3-chloro-5-(cyclopropylmethoxy)-4-ethoxybenzamido)-2-methylbenzoic acid 
• 1272527-66-8 4-(3-chloro-5-ethoxy-4-isopropoxybenzamido)-2-methylbenzoic acid 
• 1272528-50-3 methyl 4-(3-chloro-5-isopropoxy-4-methoxybenzamido)-2-methylbenzoate 
• 1272527-56-6 4-(3-chloro-5-isopropoxy-4-methoxybenzamido)-2-methylbenzoic acid 
• 1272527-60-2 4-(3-chloro-4-ethoxy-5-isopropoxybenzamido)-2-fluorobenzoic acid 
• 1272527-58-8 4-(3-chloro-5-isopropoxy-4-methoxybenzamido)-2-fluorobenzoic acid 
• 1309825-70-4 4-(3-chloro-5-ethoxy-4-isopropoxybenzamido)benzoic acid 

Relevant articles and documents

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.