Description

4-[3-Ethoxy-3-Oxoprop-1-En-1-Yl]Bicyclo[2.2.2]Octane-1-Carboxylic Acid is a high-value, structurally complex organic compound featuring a bicyclo[2.2.2]octane core functionalized with both a carboxylic acid and an ethoxycarbonyl-substituted propenyl group. This unique architecture makes it a critical advanced pharmaceutical intermediate and a versatile building block for sophisticated organic synthesis. It is primarily utilized by R&D chemists and process development scientists in the pharmaceutical, agrochemical, and advanced materials sectors to construct novel molecular frameworks with specific three-dimensional properties.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of complex drug candidates, particularly those requiring rigid, three-dimensional scaffolds for targeted biological activity.
• Agrochemical Synthesis: Used in the research and development of novel pesticides and herbicides where the bicyclic structure can impart stability and unique mode-of-action.
• Advanced Material Precursor: Serves as a monomer or cross-linking agent in the development of specialty polymers with tailored thermal or mechanical properties.
• Organic Synthesis Building Block: Employed in academic and industrial research for constructing complex natural product analogs and novel chemical entities via its reactive carboxylic acid and alkene functionalities.
• Ligand and Catalyst Development: The rigid bicyclic framework can be used to develop novel chiral ligands or organocatalysts for asymmetric synthesis.

Basic Information

Item	Details
Product Name	4-[3-Ethoxy-3-Oxoprop-1-En-1-Yl]Bicyclo[2.2.2]Octane-1-Carboxylic Acid
CAS No.	1308729-02-3
Molecular Formula	C15H20O4
Molecular Weight	264.32 g/mol
Synonyms	4-[(1E)-3-Ethoxy-3-oxoprop-1-en-1-yl]bicyclo[2.2.2]octane-1-carboxylic acid; 4-(3-Ethoxy-3-oxoprop-1-enyl)bicyclo[2.2.2]octane-1-carboxylic acid; 4-(trans-3-Ethoxycarbonylacryloyl)bicyclo[2.2.2]octane-1-carboxylic acid; Bicyclo[2.2.2]octane-1-carboxylic acid, 4-[3-ethoxy-3-oxo-1-propen-1-yl]-; 4-Carboxybicyclo[2.2.2]oct-1-yl 3-ethoxyacrylate
EINECS	Contact for details

Quality Control

Our production of 4-[3-Ethoxy-3-Oxoprop-1-En-1-Yl]Bicyclo[2.2.2]Octane-1-Carboxylic Acid adheres to stringent quality management protocols. Every batch is characterized and tested using advanced analytical techniques including HPLC, GC, NMR, and MS to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical specifications. Our quality system is designed to support cGMP compliance for pharmaceutical applications.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). The compound may be hygroscopic (moisture-sensitive); keep the container tightly sealed under an inert atmosphere if specified. Keep away from strong oxidizing agents, strong bases, and strong acids.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 20 ppm

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.