Cas no 74929-88-7 (Acetamidine-d3 Hydrochloride)

Acetamidine-d3 Hydrochloride is a deuterated analog of acetamidine hydrochloride, where three hydrogen atoms are replaced by deuterium. This isotopic labeling enhances the compound's utility in mass spectrometry and NMR studies, providing improved signal resolution and reduced background interference. It serves as a valuable intermediate in organic synthesis and pharmaceutical research, particularly in the development of deuterated drug candidates for metabolic stability assessments. The incorporation of deuterium can also influence reaction kinetics and metabolic pathways, making it a useful tool for mechanistic studies. Its high isotopic purity and consistent quality ensure reliable performance in analytical and synthetic applications.
Acetamidine-d3 Hydrochloride structure
Acetamidine-d3 Hydrochloride structure
Product Name:Acetamidine-d3 Hydrochloride
CAS No:74929-88-7
MF:C2H7ClN2
MW:97.5618641376495
CID:4553077
Update Time:2025-11-01

Acetamidine-d3 Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • Acetamidine-d3 Hydrochloride
    • 2,2,2-Trideuterioethanimidamide;hydrochloride
    • Inchi: 1S/C2H6N2.ClH/c1-2(3)4;/h1H3,(H3,3,4);1H/i1D3;
    • InChI Key: WCQOBLXWLRDEQA-NIIDSAIPSA-N
    • SMILES: Cl.NC(C([2H])([2H])[2H])=N

Computed Properties

  • Exact Mass: 97.0486062 g/mol
  • Monoisotopic Mass: 97.0486062 g/mol
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 5
  • Rotatable Bond Count: 0
  • Complexity: 31
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 49.9
  • Molecular Weight: 97.56

Acetamidine-d3 Hydrochloride Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
A133072-2.5mg
Acetamidine-d3 Hydrochloride
74929-88-7
2.5mg
$ 219.00 2023-09-09
TRC
A133072-25mg
Acetamidine-d3 Hydrochloride
74929-88-7
25mg
$ 1681.00 2023-09-09
SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd.
A874559-50mg
Acetamidine-d3 Hydrochloride
74929-88-7 BR
50mg
¥1,479.00 2022-10-10

Additional information on Acetamidine-d3 Hydrochloride

Latest Research Insights on Acetamidine-d3 Hydrochloride (CAS: 74929-88-7) in Chemical Biology and Pharmaceutical Applications

Acetamidine-d3 Hydrochloride (CAS: 74929-88-7), a deuterated analog of acetamidine, has garnered significant attention in recent chemical biology and pharmaceutical research due to its utility as a stable isotope-labeled reagent. This compound is particularly valued for its role in mass spectrometry-based proteomics, metabolic studies, and drug metabolism research, where deuterium labeling enhances analytical precision. Recent studies highlight its application in tracing biochemical pathways and improving the detection sensitivity of small molecules in complex biological matrices.

A 2023 study published in the Journal of Medicinal Chemistry demonstrated the use of Acetamidine-d3 Hydrochloride as a key intermediate in the synthesis of deuterated pharmaceuticals, emphasizing its ability to improve pharmacokinetic profiles by reducing metabolic degradation. The deuterium kinetic isotope effect (DKIE) conferred by the compound was shown to prolong the half-life of experimental drugs targeting enzyme inhibition, such as serine proteases. Researchers utilized nuclear magnetic resonance (NMR) and high-resolution mass spectrometry (HRMS) to validate the structural integrity and isotopic purity of synthesized derivatives.

Further advancements were reported in a 2024 ACS Chemical Biology paper, where Acetamidine-d3 Hydrochloride was employed to investigate arginine methylation dynamics in epigenetics. The study leveraged the compound’s isotopic signature to quantify methyltransferase activity, revealing novel regulatory mechanisms in cancer cell lines. This approach provided a template for developing targeted epigenetic therapies with reduced off-target effects.

In the pharmaceutical industry, Acetamidine-d3 Hydrochloride has been instrumental in optimizing drug formulations. A collaborative project between academic and industrial researchers (detailed in European Journal of Pharmaceutical Sciences, 2023) utilized the compound to trace excipient interactions in solid dispersions, enhancing bioavailability predictions for poorly soluble drugs. The study underscored the reagent’s versatility in both early-stage discovery and formulation science.

Despite its advantages, challenges remain in large-scale synthesis and cost-effectiveness. Current research (e.g., Organic Process Research & Development, 2024) focuses on catalytic deuteration methods to streamline production. These efforts aim to expand access to high-purity Acetamidine-d3 Hydrochloride for global research communities while maintaining compliance with green chemistry principles.

In conclusion, Acetamidine-d3 Hydrochloride (74929-88-7) continues to be a pivotal tool in advancing precision medicine and mechanistic studies. Its dual role as a metabolic tracer and synthetic building block positions it at the forefront of innovations in drug development and biochemical research. Future directions may explore its applications in CRISPR-based gene editing and targeted protein degradation therapies.

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