Description

Bicyclo[2.2.2]Octane-1-Propanoic Acid, 4-[[[6-Amino-1,2,3,4-Tetrahydro-2,4-Dioxo-3-Propyl-1-(Propyl-1,1,2,2,3,3,3-D7)-5-Pyrimidinyl]Amino]Carbonyl]- is a sophisticated, deuterated organic compound designed for advanced research and development applications. This high-purity chemical serves as a critical building block and analytical standard in the development of novel pharmaceuticals and agrochemicals. It is primarily utilized by R&D chemists and process development scientists in the pharmaceutical, biotechnology, and agrochemical industries for applications requiring isotopically labeled compounds.

Application

• Pharmaceutical Intermediate: Acts as a key synthetic precursor or labeled analog in the research and development of new active pharmaceutical ingredients (APIs).
• Metabolic and Pharmacokinetic Studies: The deuterium labeling makes it an essential tool for use as an internal standard in LC-MS/MS analysis for drug metabolism and pharmacokinetics (DMPK) studies.
• Agrochemical Research: Employed in the synthesis of novel, labeled pesticide or herbicide candidates for efficacy and environmental fate studies.
• Isotope Labeling Chemistry: Used in methodological development for deuteration strategies and in studying reaction mechanisms.
• Reference Standard: Serves as a high-purity certified reference material (CRM) for quality control and analytical method validation in regulated laboratories.

Basic Information

Product Name	Bicyclo[2.2.2]Octane-1-Propanoic Acid, 4-[[[6-Amino-1,2,3,4-Tetrahydro-2,4-Dioxo-3-Propyl-1-(Propyl-1,1,2,2,3,3,3-D7)-5-Pyrimidinyl]Amino]Carbonyl]-
CAS No.	959958-69-1
Molecular Formula	C21H22D7N5O5
Molecular Weight	Contact for details
Synonyms	4-({[6-Amino-1-(1,1,2,2,3,3,3-heptadeuteriopropyl)-2,4-dioxo-3-propyl-1,2,3,4-tetrahydro-5-pyrimidinyl]amino}carbonyl)bicyclo[2.2.2]octane-1-propanoic acid; Deuterated Bicyclo[2.2.2]octane Pyrimidine Derivative; 1-(Propyl-d7)-3-Propyl-6-aminouracil Bicyclo[2.2.2]octane Carboxamide; CAS 959958-69-1; [D7]-Labeled Uracil Derivative; Bicyclo[2.2.2]octane-1-propanoic acid, 4-[[[6-amino-1,2,3,4-tetrahydro-2,4-dioxo-3-propyl-1-(propyl-d7)-5-pyrimidinyl]amino]carbonyl]-
EINECS	Contact for details

Quality Control

Our Bicyclo[2.2.2]Octane-1-Propanoic Acid derivative is manufactured under strict quality management systems. Each batch undergoes comprehensive analytical characterization using techniques including NMR (1H, 13C), HPLC, and LC-MS to confirm identity, chemical purity, and isotopic enrichment. Certificates of Analysis (COA) detailing all specifications are provided and can be tailored to meet specific client or regulatory requirements.

Storage

Preserve in a tightly closed container, protected from light. Store at controlled room temperature (15-25°C) in a dry, well-ventilated area. For long-term storage, consider storing under inert atmosphere at -20°C to maximize stability.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 95.0%
Deuterium Enrichment (LC-MS)	≥ 98 atom % D
Water Content (KF)	≤ 1.0%
Residue on Ignition	≤ 0.5%

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