3-Methoxybenzoic acid CAS 586-38-9

Chemical Name: 3-Methoxybenzoic acid
CAS No.: 586-38-9
Molecular Fomula: C8H8O3
Molecular weight: 152.15
Appearance: Off-white to light yellowish beige powder

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3-Methoxybenzoic Acid (CAS 586-38-9) Comprehensive Technical Guide

1. Product Overview & Specifications

3-Methoxybenzoic Acid (CAS 586-38-9), also known as m-Anisic Acid, is a white to off-white crystalline powder with the molecular formula C8H8O3 and a molecular weight of 152.15 g/mol. It is a methoxy-substituted benzoic acid derivative widely used in pharmaceutical and chemical synthesis.

Key Specifications:

Parameter Value
CAS Number 586-38-9
Purity ≥98%
Melting Point 105–107°C
Boiling Point 308°C (760 mmHg), 170–172°C (10 mmHg)
Solubility Soluble in ethanol, ether; insoluble in water
Density 1.2 g/cm³
Refractive Index 1.546

2. Applications & Industrial Uses

Pharmaceutical Intermediate

3-Methoxybenzoic acid serves as a critical precursor in synthesizing antibiotics, anti-inflammatory agents, and specialty chemicals. For example, it is utilized in the preparation of europium (III) and gadolinium (III) complexes for luminescent materials.

Organic Synthesis

  • Esterification: Converts aromatic carboxylic acids to methyl esters using NaBH4-THF-methanol systems.
  • Reduction Reactions: Acts as a substrate for producing primary alcohols.

3. Case Studies & Practical Implementations

Case Study 1: Pharmaceutical Research

A leading pharmaceutical company employed 3-Methoxybenzoic acid as an intermediate in developing a novel anti-inflammatory drug. The compound’s stability under acidic conditions enabled efficient large-scale synthesis.

Case Study 2: Material Science

Researchers at a European university synthesized gadolinium-based contrast agents using 3-Methoxybenzoic acid, enhancing MRI imaging resolution. The project highlighted its role in optimizing metal-ligand coordination.

4. Safety & Handling Guidelines

Aspect Details
Storage 2–8°C in airtight containers, away from light
Hazard Codes Xi (Irritant)
LD50 (Mouse, Intraperitoneal) 250 mg/kg
Environmental Impact Avoid release into waterways; bioaccumulation risk

5. Inquiry & Contact Information

For technical specifications, bulk pricing, or custom synthesis requests, contact our team:

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