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Specifications
| Appearance: | Off white to pale yellow powder |
| Purity (HPLC): | 98% min |
| Melting Point: | 68℃ to 71℃ |
| Loss on drying: | 0.5% max |
| Residue on ignition: | 0.5% max |
| 1H-NMR: | Conforms to structure |
| IR: | Conforms to reference |
Applications
1. Pharmaceutical Intermediate
Used as a key building block in the synthesis of biologically active molecules.
Common in the development of indole-based drug candidates, including:
Anticancer agents
Antimicrobial compounds
Serotonin receptor modulators
Enables rapid diversification via further modification at the ester or indole positions.
2. Agrochemical Synthesis
Serves as an intermediate in plant growth regulators, fungicides, and insecticides.
Indole derivatives are known to affect auxin-related plant hormone pathways.
3. Heterocyclic Chemistry Research
Valuable for researchers exploring novel heterocyclic compounds.
Its reactive ester group allows for further functionalization (e.g., amidation, hydrolysis to acid).
4. Material Science and Dye Chemistry
In some exploratory fields, indole derivatives are examined for optical, electronic, or fluorescent properties.
Potential use in organic light-emitting materials or molecular sensors.
Benefits
✅ Versatile Reactivity
The ester moiety allows for easy conversion into acids, amides, or alcohols, enabling diverse chemical transformations.
✅ Stable and Easy to Handle
Methyl indole-4-carboxylate is a solid under ambient conditions and relatively stable, simplifying storage and handling.
✅ Facilitates Medicinal Chemistry
Its indole core, a privileged scaffold in drug discovery, makes it particularly valuable for structure–activity relationship (SAR) studies.
✅ Efficient Precursor
Used in one-pot or stepwise syntheses, saving time and cost during compound library generation or scale-up processes.
Conclusion
Methyl indole-4-carboxylate (CAS 39830-66-5) is a widely used intermediate in the pharmaceutical and agrochemical industries. As part of the indole family, it supports the synthesis of diverse biologically active compounds. Its structural versatility and reactivity make it especially useful in medicinal chemistry, heterocyclic compound synthesis, and research applications.
