Description

6,7-Isoquinolinediol, 1,2,3,4-Tetrahydro-1-[[(1-Methyl-1H-Tetrazol-5-Yl)Thio]Methyl]-, Dibenzoate (Ester) (9Ci) is a high-purity, complex heterocyclic compound with significant potential in advanced pharmaceutical research and development. This specialty chemical serves as a critical synthetic intermediate or a key pharmacophore for designing novel therapeutic agents. It is primarily utilized by research institutions and pharmaceutical companies engaged in the discovery of new drug candidates, particularly in areas requiring sophisticated molecular scaffolds. The compound, identified by CAS 80129-06-2, is supplied under stringent quality controls to meet the exacting standards of modern chemical synthesis.

Application

• Pharmaceutical Intermediate: A key building block in the synthesis of novel active pharmaceutical ingredients (APIs) targeting central nervous system (CNS) disorders, cardiovascular diseases, or other therapeutic areas.
• Medicinal Chemistry Research: Used as a core scaffold or precursor for structure-activity relationship (SAR) studies and lead optimization in drug discovery programs.
• Biochemical Tool Compound: Potential application as a probe or inhibitor in enzymatic assays and biochemical pathway studies due to its unique isoquinoline and tetrazole structure.
• Organic Synthesis Reagent: Employed in advanced organic synthesis for constructing complex nitrogen-containing heterocycles, leveraging its functional groups for further chemical transformations.
• Reference Standard: Serves as a high-purity analytical standard for quality control and method development in pharmaceutical analysis laboratories.

Basic Information

Product Name	6,7-Isoquinolinediol, 1,2,3,4-Tetrahydro-1-[[(1-Methyl-1H-Tetrazol-5-Yl)Thio]Methyl]-, Dibenzoate (Ester) (9Ci)
CAS No.	80129-06-2
Molecular Formula	C26H23N5O4S
Molecular Weight	501.56 g/mol
Synonyms	1,2,3,4-Tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-6,7-isoquinolinediol dibenzoate; 6,7-Dihydroxy-1,2,3,4-tetrahydroisoquinoline-1-methanethiol, 1-methyl-1H-tetrazol-5-yl ester, dibenzoate; 1-[(1-Methyl-1H-tetrazol-5-ylthio)methyl]-1,2,3,4-tetrahydro-6,7-isoquinolinediol dibenzoate; Tetrahydroisoquinoline derivative (80129-06-2); THIQ-tetrazole derivative; 6,7-Bis(benzoyloxy)-1,2,3,4-tetrahydro-1-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]isoquinoline
EINECS	Contact for details

Quality Control

Our 6,7-Isoquinolinediol, 1,2,3,4-Tetrahydro-1-[[(1-Methyl-1H-Tetrazol-5-Yl)Thio]Methyl]-, Dibenzoate (Ester) (9Ci) is manufactured under a strict quality management system. Each batch undergoes comprehensive analytical testing, including HPLC, NMR, and mass spectrometry, to ensure identity, purity, and consistency. A detailed Certificate of Analysis (COA) is provided with every shipment, documenting all critical quality attributes. We support compliance with ICH guidelines for stability and impurity profiling upon request.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (15-25°C). This compound may be light-sensitive and should be handled under appropriate conditions to maintain stability. Keep away from strong oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white powder
Identification (IR)	Conforms to structure
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.