Cas no 1219803-88-9 (N,N-Diisopropylamine-d14 Hydrochloride)

N,N-Diisopropylamine-d14 Hydrochloride is a deuterated form of N,N-diisopropylamine hydrochloride, where all hydrogen atoms are replaced by deuterium (D). This isotopically labeled compound is primarily used as a reagent in NMR spectroscopy and mass spectrometry, offering enhanced signal resolution and reduced interference in deuterated solvents. Its high isotopic purity (>98% D) ensures reliable results in structural elucidation and kinetic studies. The hydrochloride salt form improves stability and solubility in aqueous and organic matrices. This compound is particularly valuable in pharmaceutical research, metabolic studies, and mechanistic investigations where precise tracking of molecular interactions is required. Its consistent performance makes it a preferred choice for analytical applications.
N,N-Diisopropylamine-d14 Hydrochloride structure
1219803-88-9 structure
Product Name:N,N-Diisopropylamine-d14 Hydrochloride
CAS No:1219803-88-9
MF:C6H16ClN
MW:151.737204551697
CID:1062965
PubChem ID:71316287
Update Time:2025-10-19

N,N-Diisopropylamine-d14 Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • N,N-Diisopropylamine-d14 Hydrochloride
    • 1,1,1,2,3,3,3-heptadeuterio-N-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)propan-2-amine,hydrochloride
    • Dimethyldiethylamine Hydrochloride
    • N-(1-Methylethyl)-2-propanamine Hydrochloride
    • N-[(~2~H_7_)Propan-2-yl](~2~H_7_)propan-2-amine--hydrogen chloride (1/1)
    • 1219803-88-9
    • CS-0590594
    • Di-iso-propyl-d14-amine hcl
    • D98301
    • DTXSID10747691
    • HY-Y0853BS
    • Diisopropylamine-d14 (hydrochloride)
    • 1,1,1,2,3,3,3-heptadeuterio-N-(1,1,1,2,3,3,3-heptadeuteriopropan-2-yl)propan-2-amine;hydrochloride
    • N,N-Diisopropylamine-d14, Hydrochloride
    • Diisopropylamine-d14 hydrochloride
    • DA-52558
    • Inchi: 1S/C6H15N.ClH/c1-5(2)7-6(3)4;/h5-7H,1-4H3;1H/i1D3,2D3,3D3,4D3,5D,6D;
    • InChI Key: URAZVWXGWMBUGJ-VSHQPLEZSA-N
    • SMILES: Cl.N(C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]

Computed Properties

  • Exact Mass: 151.18500
  • Monoisotopic Mass: 151.1850017g/mol
  • Isotope Atom Count: 14
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 33.4
  • 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: 12?2

Experimental Properties

  • Melting Point: 210-212°C
  • PSA: 12.03000
  • LogP: 2.58570

N,N-Diisopropylamine-d14 Hydrochloride Security Information

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Additional information on N,N-Diisopropylamine-d14 Hydrochloride

Introduction to N,N-Diisopropylamine-d14 Hydrochloride (CAS No. 1219803-88-9)

N,N-Diisopropylamine-d14 Hydrochloride is a specialized chemical compound that has garnered significant attention in the field of pharmaceutical research and development. This deuterated derivative of N,N-diisopropylamine is widely utilized in various scientific applications, particularly in the synthesis of labeled biomolecules and the study of metabolic pathways. The compound's molecular structure, characterized by the presence of deuterium atoms, makes it an invaluable tool for researchers seeking high precision in their experimental designs.

The chemical formula for N,N-Diisopropylamine-d14 Hydrochloride can be represented as C6H15ClND3·HCl, where the deuterium atoms (denoted as 'd14') replace hydrogen atoms in the original molecule. This substitution not only enhances the compound's stability but also allows for more accurate tracing of biochemical reactions in vitro and in vivo. The hydrochloride salt form ensures better solubility in aqueous solutions, making it easier to incorporate into a wide range of experimental protocols.

In recent years, N,N-Diisopropylamine-d14 Hydrochloride has been extensively used in the study of neurotransmitter systems. Its deuterated nature facilitates the development of radioligands that are employed in positron emission tomography (PET) scans to visualize and quantify neurotransmitter receptors in the brain. Such studies are crucial for understanding neurological disorders and developing targeted therapies. The compound's ability to mimic natural aminoalkanes while providing a distinct isotopic signature has made it a preferred choice for researchers aiming to unravel complex neural mechanisms.

Moreover, this compound has found applications in drug discovery and development pipelines. Its use as a labeled intermediate allows chemists to synthesize complex molecules with high fidelity, enabling the creation of novel pharmacophores with improved pharmacokinetic properties. The incorporation of deuterium atoms into drug candidates has been shown to enhance metabolic stability, leading to longer half-lives and reduced clearance rates. This phenomenon, known as deuterium effect, has been extensively studied and validated across various therapeutic areas.

Recent advancements in mass spectrometry techniques have further highlighted the utility of N,N-Diisopropylamine-d14 Hydrochloride in analytical chemistry. The compound's unique isotopic signature provides a powerful tool for identifying and quantifying trace amounts of analytes in complex mixtures. This capability is particularly valuable in environmental monitoring and food safety assessments, where detecting minute concentrations of specific compounds is essential for regulatory compliance and public health.

The synthesis of N,N-Diisopropylamine-d14 Hydrochloride involves a multi-step process that requires precise control over reaction conditions to ensure high yield and purity. Industrial manufacturers employ advanced catalytic systems and purification techniques to produce this compound with minimal impurities. The demand for high-purity labeled chemicals continues to grow, driven by the increasing complexity of modern research methodologies and the need for more accurate data interpretation.

As research methodologies continue to evolve, the role of labeled compounds like N,N-Diisopropylamine-d14 Hydrochloride is expected to expand further. Innovations in synthetic chemistry and analytical techniques are likely to unlock new applications for this versatile chemical entity. Researchers across academia and industry are increasingly recognizing the value of deuterated compounds in advancing scientific understanding and developing cutting-edge solutions to global challenges.

In conclusion, N,N-Diisopropylamine-d14 Hydrochloride (CAS No. 1219803-88-9) stands as a cornerstone in modern chemical research, offering unparalleled precision and versatility in its applications. From neuroscience to drug discovery, this compound continues to play a pivotal role in shaping our understanding of biological systems and developing innovative therapeutic strategies. As science progresses into an era of greater sophistication and precision, compounds like these will remain indispensable tools for researchers striving to push the boundaries of knowledge.

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