Cas no 10036-09-6 (bicyclo3.3.1nonan-3-one)

Bicyclo[3.3.1]nonan-3-one is a bicyclic ketone with a rigid molecular framework, making it a valuable intermediate in organic synthesis and pharmaceutical research. Its strained ring structure imparts unique reactivity, particularly in cycloaddition and rearrangement reactions. The compound’s stability and defined stereochemistry are advantageous for constructing complex polycyclic systems. It is also utilized in the study of conformational dynamics due to its well-defined geometry. High purity grades are available for precise applications, ensuring reproducibility in synthetic pathways. Its versatility and structural distinctiveness make it a preferred choice for advanced chemical research and development.
bicyclo3.3.1nonan-3-one structure
bicyclo3.3.1nonan-3-one structure
Product Name:bicyclo3.3.1nonan-3-one
CAS No:10036-09-6
MF:C9H14O
MW:138.206862926483
CID:198866
PubChem ID:276875
Update Time:2025-11-01

bicyclo3.3.1nonan-3-one Chemical and Physical Properties

Names and Identifiers

    • Bicyclo[3.3.1]nonan-3-one
    • 3-one-bicyclo[3.3.1]nonane
    • AC1L3B1X
    • Bicyclo(3.3.1)nonan-2-one
    • Bicyclo[3.3.1]nonan-2-on
    • bicyclo[3.3.1]nonan-2-one
    • bicyclo[3.3.1]nonane-2-one
    • bicyclo[3.3.1]nonane-3-one
    • CTK1A2670
    • NSC125570
    • SureCN5242956
    • 3-Bicyclo[3.3.1]nonanone
    • NSC 125346
    • bicyclo3.3.1nonan-3-one
    • EN300-159872
    • NSC125346
    • NSC-125346
    • DTXSID60905441
    • SCHEMBL852389
    • CS-0235667
    • Z1255416520
    • 10036-09-6
    • InChI=1/C9H14O/c10-9-5-7-2-1-3-8(4-7)6-9/h7-8H,1-6H
    • Inchi: 1S/C9H14O/c10-9-5-7-2-1-3-8(4-7)6-9/h7-8H,1-6H2
    • InChI Key: ANFLIDKLELMAAQ-UHFFFAOYSA-N
    • SMILES: O=C1CC2CCCC(C1)C2

Computed Properties

  • Exact Mass: 138.10452
  • Monoisotopic Mass: 138.104465
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 127
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 17.1
  • XLogP3: 2.1

Experimental Properties

  • Density: 1.007
  • Boiling Point: 219.8°Cat760mmHg
  • Flash Point: 79.6°C
  • Refractive Index: 1.49
  • PSA: 17.07
  • LogP: 2.15570

bicyclo3.3.1nonan-3-one Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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1PlusChem
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Additional information on bicyclo3.3.1nonan-3-one

Recent Advances in the Study of Bicyclo[3.3.1]nonan-3-one (CAS: 10036-09-6) and Its Applications in Chemical Biology and Medicine

Bicyclo[3.3.1]nonan-3-one (CAS: 10036-09-6) is a structurally unique bicyclic ketone that has garnered significant attention in recent years due to its versatile applications in chemical biology and medicinal chemistry. This compound, characterized by its rigid bicyclic framework, serves as a valuable scaffold for the synthesis of bioactive molecules and has been explored for its potential in drug discovery and development. Recent studies have focused on elucidating its chemical properties, synthetic methodologies, and biological activities, providing new insights into its utility in pharmaceutical research.

One of the key areas of research involving bicyclo[3.3.1]nonan-3-one is its role as a building block for the synthesis of complex natural products and pharmacologically active compounds. A 2023 study published in the Journal of Organic Chemistry demonstrated an efficient synthetic route to functionalized derivatives of this compound, highlighting its potential as a precursor for the development of novel therapeutics. The study employed advanced catalytic methods, including asymmetric hydrogenation, to achieve high enantioselectivity, which is critical for the production of chiral drugs.

In addition to its synthetic utility, bicyclo[3.3.1]nonan-3-one has been investigated for its biological activities. Recent findings published in Bioorganic & Medicinal Chemistry Letters revealed that certain derivatives of this compound exhibit promising antimicrobial and anti-inflammatory properties. These derivatives were shown to inhibit key enzymes involved in bacterial cell wall synthesis and inflammatory pathways, suggesting their potential as leads for new antibiotic and anti-inflammatory drugs. The study also emphasized the importance of structural modifications to enhance bioavailability and reduce toxicity.

Another notable advancement is the application of bicyclo[3.3.1]nonan-3-one in the design of enzyme inhibitors. A 2024 study in ChemMedChem reported the development of bicyclo[3.3.1]nonan-3-one-based inhibitors targeting the SARS-CoV-2 main protease. The researchers utilized molecular docking and dynamics simulations to optimize the interactions between the inhibitor and the protease active site, resulting in compounds with nanomolar affinity. This work underscores the potential of bicyclo[3.3.1]nonan-3-one derivatives in addressing emerging viral threats.

Despite these promising developments, challenges remain in the practical application of bicyclo[3.3.1]nonan-3-one derivatives. Issues such as scalability of synthesis, metabolic stability, and off-target effects need to be addressed to translate these findings into clinically viable therapeutics. Future research directions may include the exploration of novel synthetic strategies, such as biocatalysis or flow chemistry, to improve efficiency and sustainability. Additionally, further in vivo studies are required to validate the efficacy and safety of these compounds in animal models and human trials.

In conclusion, bicyclo[3.3.1]nonan-3-one (CAS: 10036-09-6) represents a promising scaffold in chemical biology and medicinal chemistry, with recent studies highlighting its potential in drug discovery and enzyme inhibition. Continued research efforts are expected to unlock new applications and overcome existing limitations, paving the way for the development of innovative therapeutics. This brief provides a snapshot of the current state of research and underscores the importance of interdisciplinary collaboration in advancing this field.

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