Cas no 1116-45-6 (1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol)

1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol is a structured triglyceride featuring a unique combination of palmitic acid esters at distinct positions on the glycerol backbone. This compound is characterized by its asymmetric acyl distribution, with a single palmityl group at the sn-1 position and two palmitoyl groups at the sn-2 and sn-3 positions. Such a configuration influences its physicochemical properties, including melting behavior and solubility, making it suitable for applications in lipid research, pharmaceuticals, and specialty formulations. Its well-defined structure allows for precise studies on lipid metabolism, enzymatic specificity, and membrane interactions. The compound is synthesized under controlled conditions to ensure high purity and consistency, meeting rigorous analytical standards.
1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol structure
1116-45-6 structure
Product Name:1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol
CAS No:1116-45-6
MF:C51H100O5
MW:793.336717605591
CID:193947
Update Time:2025-10-29

1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol Chemical and Physical Properties

Names and Identifiers

    • Hexadecanoic acid,1-[(hexadecyloxy)methyl]-1,2-ethanediyl ester (9CI)
    • (2-hexadecanoyloxy-3-hexadecoxypropyl) hexadecanoate
    • 1,2-DIPALMITOYL-3-O-HEXADECYL-RAC-GLYCEROL
    • 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol
    • 1,2-Dipalmitoyl-3-O-palmityl-rac-glycerol
    • 1-O-hexadecyl-2,3-dihexadecanoylglycerol
    • 1-O-Hexadecyl-2,3-dihexadecanoyl-rac-glycerol
    • 1-O-hexadecyl-2,3-O-dihexadecanoyl glycerol
    • 1-O-hexyadecyl-2,3-dipalmitoyl-rac-glycerol
    • CHIMYL DIPALMITATE
    • Glycerin-1,2-dipalmitat-3-hexadecylether
    • Inchi: 1S/C51H100O5/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-54-47-49(56-51(53)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)48-55-50(52)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h49H,4-48H2,1-3H3
    • InChI Key: PPDBIVVWNXSKCW-UHFFFAOYSA-N
    • SMILES: O(CC(COC(CCCCCCCCCCCCCCC)=O)OC(CCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCCCC

Computed Properties

  • Exact Mass: 792.75700
  • Monoisotopic Mass: 792.757
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 56
  • Rotatable Bond Count: 50
  • Complexity: 769
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 22.3

Experimental Properties

  • Density: 0.897
  • Boiling Point: 769.1°Cat760mmHg
  • Flash Point: 289.9°C
  • Refractive Index: 1.463
  • PSA: 61.83000
  • LogP: 16.90190

1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol Security Information

  • WGK Germany:3
  • Storage Condition:?20°C

1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol Pricemore >>

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Additional information on 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol

Professional Introduction to 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol (CAS No. 1116-45-6)

1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol, a compound with the chemical identifier CAS No. 1116-45-6, is a glycerolipid derivative that has garnered significant attention in the field of pharmaceutical chemistry and biomedicine. This compound, characterized by its unique structural composition, exhibits a range of potential applications that span from drug delivery systems to bioactive lipid research. The name 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol itself provides a detailed insight into its molecular structure, highlighting the presence of two palmityl (C16:0) chains attached at the sn-1 and sn-3 positions of glycerol, while the sn-2 position remains unesterified.

The significance of this compound lies in its ability to form stable lipid nanoparticles, which are increasingly being utilized in the formulation of therapeutic agents. These nanoparticles offer advantages such as improved solubility, targeted delivery, and controlled release profiles, making them particularly valuable in the development of novel drug formulations. Recent studies have demonstrated the efficacy of lipid-based nanoparticles in enhancing the bioavailability of hydrophobic drugs, thereby optimizing treatment outcomes.

In the context of current research, 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol has been explored for its role in modulating cellular membranes and lipoprotein metabolism. Its structural similarity to natural phospholipids allows it to integrate seamlessly into biological membranes, potentially influencing membrane fluidity and permeability. This property has been investigated in relation to its potential applications in anti-inflammatory and anti-apoptotic therapies. Moreover, the compound’s ability to interact with cellular receptors and transporters has opened new avenues for research in drug targeting and delivery.

One of the most compelling aspects of 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol is its versatility in forming various lipid-based carriers. For instance, it can be used to create cationic liposomes, which are particularly effective in delivering nucleic acid-based therapies such as mRNA vaccines. The stability and biocompatibility of these liposomes make them suitable for clinical applications, as evidenced by their use in several preclinical trials focused on gene therapy and cancer treatment. The CAS No. 1116-45-6 registry further underscores its identity as a well-characterized compound with established chemical properties.

The synthesis and characterization of 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol have been refined through advanced chemical methodologies, ensuring high purity and consistency. Techniques such as thin-layer chromatography (TLC), high-performance liquid chromatography (HPLC), and nuclear magnetic resonance (NMR) spectroscopy have been employed to validate its molecular structure. These analytical methods not only confirm the identity of the compound but also provide insights into its conformational dynamics and interactions with other biomolecules.

Recent advancements in computational chemistry have also contributed to a deeper understanding of 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol’s behavior. Molecular dynamics simulations have revealed how this compound interacts with biological membranes at an atomic level, offering predictive models for drug design and formulation optimization. Such simulations are crucial for anticipating potential side effects and improving the efficacy of lipid-based drug delivery systems.

The pharmaceutical industry has shown particular interest in leveraging the properties of 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol for developing novel therapeutics. Its role as a key component in lipid nanocarriers has been highlighted in several patents and clinical trials targeting diseases such as cancer, neurodegenerative disorders, and infectious diseases. The ability to customize its physicochemical properties makes it an attractive candidate for tailored drug delivery solutions.

In conclusion, 1-O-Palmityl-2,3-dipalmitoyl-rac-glycerol represents a significant advancement in lipid chemistry with far-reaching implications for biomedical applications. Its unique structural features and functional versatility position it as a cornerstone material in the development of innovative drug formulations. As research continues to uncover new possibilities for this compound, its importance in pharmaceutical science is likely to grow even further.

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