Description

3-Isoquinolinecarboxylic Acid, 6-[3-Chloro-2-(1H-Tetrazol-5-Yl)Phenoxy]Decahydro-, 2-Ethylbutyl Ester, (3S,4As,6S,8Ar)-, Mono(4-Methylbenzenesulfonate) (9Ci) is a high-purity, complex organic compound designed for advanced research and development applications. This compound is valued for its specific structural features, including the isoquinoline and tetrazole moieties, which are of significant interest in medicinal chemistry and materials science. It serves as a critical intermediate or building block for researchers and developers in the pharmaceutical and agrochemical industries seeking to create novel active ingredients.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the synthesis of novel drug candidates, particularly those targeting specific enzyme pathways.
• Agrochemical Research: Used in the development of new herbicides, fungicides, or insecticides, leveraging its heterocyclic structure for bioactivity.
• Chemical Biology Probe: Acts as a specialized tool compound for studying biological processes and target validation in academic and industrial research labs.
• Material Science Precursor: Potential use in the synthesis of advanced organic materials, such as ligands for catalysts or components for electronic materials.
• Process Chemistry Development: Employed in route scouting and optimization for the scalable production of complex molecules.

Basic Information

Product Name	3-Isoquinolinecarboxylic Acid, 6-[3-Chloro-2-(1H-Tetrazol-5-Yl)Phenoxy]Decahydro-, 2-Ethylbutyl Ester, (3S,4As,6S,8Ar)-, Mono(4-Methylbenzenesulfonate) (9Ci)
CAS No.	503291-53-0
Molecular Formula	Contact for details
Molecular Weight	Contact for details
Synonyms	(3S,4aS,6S,8aR)-6-[3-Chloro-2-(1H-tetrazol-5-yl)phenoxy]decahydroisoquinoline-3-carboxylic acid 2-ethylbutyl ester 4-methylbenzenesulfonate; (3S,4aS,6S,8aR)-6-[3-Chloro-2-(1H-tetrazol-5-yl)phenoxy]decahydro-3-isoquinolinecarboxylic acid 2-ethylbutyl ester 4-methylbenzenesulfonate; 3-Isoquinolinecarboxylic acid, 6-[3-chloro-2-(1H-tetrazol-5-yl)phenoxy]decahydro-, 2-ethylbutyl ester, (3S,4aS,6S,8aR)-, 4-methylbenzenesulfonate; 2-Ethylbutyl (3S,4aS,6S,8aR)-6-[3-chloro-2-(1H-tetrazol-5-yl)phenoxy]decahydroisoquinoline-3-carboxylate 4-methylbenzenesulfonate; Decahydro-6-[3-chloro-2-(1H-tetrazol-5-yl)phenoxy]-3-isoquinolinecarboxylic acid 2-ethylbutyl ester p-toluenesulfonate (stereochemistry specified); CAS 503291-53-0
EINECS	Contact for details

Quality Control

Our 3-Isoquinolinecarboxylic Acid derivative is manufactured under strict quality management systems to ensure batch-to-batch consistency and high purity. Each lot undergoes comprehensive analytical testing, including HPLC for purity and spectroscopic identification (NMR, IR, MS). A detailed Certificate of Analysis (COA) is provided with every shipment, documenting the results against agreed specifications to support your regulatory and R&D requirements.

Storage

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

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to reference spectrum
Identification (HPLC)	Retention time matches reference standard
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.