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Methyl 4-acetyl-5-oxohexanoate (CAS 13984-53-7) Manufacturer India

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High-Purity Methyl 4-acetyl-5-oxohexanoate. A versatile tri-carbonyl building block and essential intermediate for pyrrole synthesis and API development.

Chemical Structure of Methyl 4-acetyl-5-oxohexanoate

Methyl 4-acetyl-5-oxohexanoate

CAS No: 13984-53-7

A high-purity tri-carbonyl intermediate used as a key starting material (KSM) or building block for pyrrole synthesis (Knorr condensation) and biological drug discovery applications.

This multifunctional compound contains a methyl ester, an acetyl group, and a ketone, offering unique reactivity profiles. Kalpasthana Life Care Products ensures strict quality testing and consistency to support advanced pharmaceutical and research applications.

Product Specifications

Product Name Methyl 4-acetyl-5-oxohexanoate
Synonyms / Alternate Names 4-Acetyl-5-oxohexanoic acid methyl ester, Methyl 4-acetyl-5-oxohexanoate
CAS Number 13984-53-7
Molecular Formula C9H14O4
Molecular Weight 186.21 g/mol
Appearance Colorless to light yellow liquid or low-melting solid
Purity (GC) ≥ 98.0%
Boiling Point 110°C - 114°C at 5 mmHg

Applications & Usage

Methyl 4-acetyl-5-oxohexanoate is a highly functionalized tri-carbonyl intermediate widely utilized in heterocyclic chemistry and drug discovery. It is an essential building block for constructing substituted pyrrole rings via modified Knorr and Paal-Knorr condensations. It serves as a key structural scaffold for the synthesis of complex active pharmaceutical ingredients (APIs), including PD-1/PD-L1 pathway inhibitors and agricultural fungicides.

Key Features

  • Substituted Pyrroles: Essential reactant for synthesizing highly substituted pyrrole-3-carboxylic acid esters (structures related to Atorvastatin family).
  • Biomedical Research: Acts as a key scaffold for constructing compound libraries in oncology, immunology, and receptor targeting.
  • Agrochemical Intermediates: Precursor for synthesizing nitrogen-rich heterocyclic fungicides, insecticides, and crop protection agents.

Product Specifications & Procurement FAQs

Detailed quality specifications, compliance data, and procurement answers for pharma sourcing professionals.

Quality & Technical Specifications

Chemical Synonyms 4-Acetyl-5-oxohexanoic acid methyl ester, Methyl 4-ethanoyl-5-oxo-hexanoate, 4-acetyl-5-keto-hexanoic acid methyl ester, Hexanoic acid, 4-acetyl-5-oxo-, methyl ester, Methyl 4-acetyl-5-oxohexanoate
Manufacturing Location Kalpasthana Life Care Products, Humnabad, Bidar District, Karnataka, India - 585330
Compliance & Quality GMP-compliant state-of-the-art facility, rigorous GC and analytical purity testing.
Commercial Packaging Standard commercial HDPE drums or customized B2B bottles; custom packaging available.

Frequently Asked Questions

What synthetic pathways utilize Methyl 4-acetyl-5-oxohexanoate?

It is primarily used to build heterocyclic structures like pyrroles and pyrazoles. Its unique tri-carbonyl structure (two ketones and one ester) allows for highly customized selective condensations and Michael reactions in organic design.

How is the quality of Kalpasthana's Methyl 4-acetyl-5-oxohexanoate controlled?

Every batch undergoes GC profiling, density, and moisture control. A comprehensive Certificate of Analysis (COA) is standard with every dispatch from our Humnabad facility.

What are the typical packaging sizes and storage instructions for Methyl 4-acetyl-5-oxohexanoate?

We pack this product in standard 25 kg plastic carboys or 200 kg steel drums. Because it contains reactive tricarbonyl groups, it should be kept in a cool, dark, dry warehouse in well-sealed containers to prevent moisture absorption and color degradation.

Technical Profile & Sourcing Guide

Comprehensive chemical specs, catalytic pathways, and quality compliance guidelines for raw materials sourcing.

Chemical Synthesis

Methyl 4-acetyl-5-oxohexanoate is a highly functionalized ester. It is synthesized via the alkylation of methyl acetoacetate or related active methylene compounds. It features multiple carbonyl groups, making it highly reactive.

Applications & Pathways

This compound is used as a specialized intermediate in the synthesis of complex heterocyclic molecules, fine chemicals, and pharmaceutical active ingredients. It is particularly valuable in creating custom chemical scaffolds.

Quality & Compliance

Our compound achieves a purity profile of >=98.0% by GC/HPLC, with full traceability and batch certification.

Storage & Packaging

It is packed in specialized containers and stored in cool, dry environments.

Safety & Protocols

Standard EHS safety protocols and detailed certificates of analysis are provided. Wear gloves and eye protection when transferring.

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