Description

1H-Isoindol-1-One,3-Ethoxyoctahydro-2,5-Dimethyl-,(3Alpha,3Aalpha,5Bta,7Aalpha)-(9Ci) is a complex, stereochemically defined heterocyclic compound, identified by CAS number 116072-16-3. This specialized chemical serves as a high-value synthetic intermediate and building block in advanced organic synthesis, prized for its unique structural framework. It is primarily sought after by research and development teams in the pharmaceutical and agrochemical sectors for constructing novel active molecules.

Application

This compound is a versatile chiral synthon used in sophisticated chemical synthesis. Key application areas include:

• Pharmaceutical Intermediate: For the research and development of new active pharmaceutical ingredients (APIs), particularly in medicinal chemistry programs.
• Agrochemical Synthesis: As a key building block in the creation of novel herbicides, fungicides, or insecticides with specific stereochemical requirements.
• Advanced Material Research: Potential use in the synthesis of specialty polymers or liquid crystals where its rigid, functionalized structure can impart specific properties.
• Asymmetric Catalysis: Serving as a precursor or ligand in the development of chiral catalysts for enantioselective synthesis.
• Academic & Contract Research: A valuable reagent for methodology development and complex natural product synthesis in university and CRO laboratories.

Basic Information

Item	Details
Product Name	1H-Isoindol-1-One,3-Ethoxyoctahydro-2,5-Dimethyl-,(3Alpha,3Aalpha,5Bta,7Aalpha)-(9Ci)
CAS No.	116072-16-3
Molecular Formula	C14H23NO2
Molecular Weight	237.34 g/mol
Synonyms	3-Ethoxyoctahydro-2,5-dimethyl-1H-isoindol-1-one; (3α,3aα,5β,7aα)-3-Ethoxyoctahydro-2,5-dimethyl-1H-isoindol-1-one; 1H-Isoindol-1-one, 3-ethoxyoctahydro-2,5-dimethyl-, (3α,3aα,5β,7aα)-; Octahydro-2,5-dimethyl-3-ethoxy-1H-isoindol-1-one; 116072-16-3; 3-Ethoxy-2,5-dimethyloctahydro-1H-isoindol-1-one
EINECS	Contact for details

Quality Control

Our production of this advanced intermediate adheres to strict quality management protocols. Each batch is characterized using advanced analytical techniques including NMR, HPLC, and GC to ensure structural integrity and purity. Certificates of Analysis (COA) detailing identity, purity, and impurity profiles are provided with every shipment. We support development and scale-up with consistent quality from milligram to kilogram quantities.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep away from strong oxidizing agents. For long-term storage, consider inert atmosphere conditions to maintain optimal stability.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%
Specific Rotation	Contact for details

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