Description

1-[3-(Dimethylamino-D6)Propyl]-1-(4-Fluoro-Phenyl)-1,3-Dihydro-Isobenzofuran-5-Carbonitrile Oxalate is a high-purity, deuterated chemical compound primarily used as a critical intermediate or reference standard in advanced pharmaceutical research and development. Its value lies in its precise isotopic labeling, which is essential for metabolic, pharmacokinetic, and bioanalytical studies, providing researchers with reliable data for drug discovery. This compound is particularly relevant for scientists and manufacturers in the pharmaceutical, biotechnology, and contract research organization (CRO) sectors working on novel therapeutic agents.

Application

• Pharmaceutical Reference Standard: Serves as a certified standard for the quantification and qualification of active pharmaceutical ingredients (APIs) and their metabolites in analytical methods.
• Deuterated Drug Intermediate: Used in the synthesis of deuterium-labeled drug candidates to enhance metabolic stability and study drug behavior.
• Metabolic Pathway Tracing: Employed in mass spectrometry-based studies to trace and identify metabolic products in biological systems.
• Bioanalytical Method Development: A key component in developing and validating sensitive LC-MS/MS and HPLC methods for preclinical and clinical studies.
• Isotope Dilution Mass Spectrometry (IDMS): Acts as an internal standard to ensure high accuracy and precision in quantitative bioanalysis.
• Pharmacokinetic/Pharmacodynamic (PK/PD) Research: Facilitates detailed studies on drug absorption, distribution, metabolism, and excretion (ADME).

Basic Information

Product Name	1-[3-(Dimethylamino-D6)Propyl]-1-(4-Fluoro-Phenyl)-1,3-Dihydro-Isobenzofuran-5-Carbonitrile Oxalate
CAS No.	1217768-91-6
Molecular Formula	C22H18D6FN3O5
Molecular Weight	Contact for details
Synonyms	1-[3-(Dimethylamino-D6)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile oxalate; 1,3-Dihydro-1-[3-[(2H6)dimethylamino]propyl]-1-(4-fluorophenyl)-2-benzofuran-5-carbonitrile ethanedioate; Deuterated Isobenzofuran Carbonitrile Oxalate; (4-Fluoro-Phenyl)-[3-(Dimethylamino-D6)Propyl] Isobenzofuran-5-Carbonitrile Oxalate; 1217768-91-6; Oxalic acid compound with 1-[3-(dimethylamino-D6)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile (1:1)
EINECS	Contact for details

Quality Control

Our products undergo rigorous quality testing to ensure compliance with industry standards. Every batch is characterized using advanced analytical techniques to confirm identity, purity, and isotopic enrichment. Certificates of Analysis (COA) detailing specific results for assay, impurities, and deuterium content are available upon request. We adhere to cGMP principles where applicable to support our clients' regulatory and research needs.

Storage

Preserve in a tightly closed container, protected from light. Store at controlled room temperature (15-25°C) in a cool, dry, and well-ventilated area. Keep away from incompatible materials.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (HPLC)	Conforms to reference standard
Purity (HPLC)	≥ 98.0%
Deuterium Enrichment (NMR/MS)	≥ 98 atom % D
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%
Heavy Metals	≤ 10 ppm

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