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1-(4-Amino-3,5-Dichloro-Phenyl)-2-tert-Butyl-D9-Amino-Ethanone CAS NO 129138-59-6
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CAS No.:129138-59-6
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
1-(4-Amino-3,5-Dichloro-Phenyl)-2-tert-Butyl-D9-Amino-Ethanone is a high-purity deuterated organic compound, specifically a tert-butylamino ethanone derivative with a dichloro-substituted aniline core. This compound is of significant value as a stable isotope-labeled intermediate or reference standard in advanced research and development. It is primarily needed by pharmaceutical and agrochemical R&D teams for applications in drug metabolism studies, pharmacokinetic research, and as a critical building block in the synthesis of novel active ingredients.
Application
- Pharmaceutical Research: Serves as a key deuterated intermediate in the synthesis of novel drug candidates, particularly for metabolic stability studies and the development of deuterium-labeled pharmaceuticals.
- Metabolite Identification & Pharmacokinetics (PK): Used as an internal standard in Liquid Chromatography-Mass Spectrometry (LC-MS) and Gas Chromatography-Mass Spectrometry (GC-MS) for accurate quantification and tracing of parent compounds and their metabolites in biological matrices.
- Agrochemical Development: Acts as a specialized building block for creating novel, labeled active ingredients or for conducting environmental fate and metabolism studies of pesticides and herbicides.
- Analytical Reference Standard: Provides a high-purity, chemically defined standard for method development, validation, and quality control in analytical laboratories.
- Isotope Labeling & Tracer Studies: The deuterium (D9) label makes it an essential tool for mechanistic studies in chemistry and biochemistry, tracking reaction pathways and molecular interactions.
Basic Information
| Product Name | 1-(4-Amino-3,5-Dichloro-Phenyl)-2-tert-Butyl-D9-Amino-Ethanone |
| CAS No. | 129138-59-6 |
| Molecular Formula | C12H7D9Cl2N2O |
| Molecular Weight | 290.25 g/mol (approx.) |
| Synonyms | 2-tert-Butylamino-1-(4-amino-3,5-dichlorophenyl)ethanone-d9; 1-(4-Amino-3,5-dichlorophenyl)-2-(tert-butylamino)ethanone-d9; 2-(tert-Butylamino)-1-(4-amino-3,5-dichlorophenyl)ethanone-d9; Deuterated 1-(4-Amino-3,5-dichloro-Phenyl)-2-tert-Butyl-Amino-Ethanone; D9-labeled tert-Butylamino Ethanone Derivative; 4-Amino-3,5-dichloro-α-[(1,1-dimethylethyl)amino]acetophenone-d9; (4-Amino-3,5-dichlorophenyl)[2-(tert-butylamino)-2-oxoethyl]d9-ketone |
| EINECS | Contact for details |
Quality Control
Our 1-(4-Amino-3,5-Dichloro-Phenyl)-2-tert-Butyl-D9-Amino-Ethanone is produced under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC for chemical purity and isotopic enrichment, NMR for structural confirmation, and MS for identity verification. We provide comprehensive Certificates of Analysis (COA) detailing all specifications, including assay, deuterium enrichment level, and impurity profiles, ensuring traceability and compliance with research-grade standards.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). The compound is light-sensitive and should be handled under appropriate conditions to maintain stability and purity. For long-term storage, consider inert atmosphere conditions.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 98.0% |
| Deuterium Enrichment (MS) | ≥ 98 atom % D |
| Water Content (KF) | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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